Chembase list of 866358 unique molecular structures

$$$$ Data More

M. F.

C3H4N2S

Suppliers	Catalog Number
Sigma Aldrich	284297 63758
MP Biomedicals	02155353
Alfa Aesar	L01346

Database	Data ID
PubChem	1201386

M. W.

100.14226

CAS

872-35-5

Similarity

N/A

ID: 92302

(2-chloroethoxy)benzene

$$$$ Data More

M. F.

C8H9ClO

Suppliers	Catalog Number
Sigma Aldrich	114278 24607
MP Biomedicals	05220405
Alfa Aesar	L11345

Database	Data ID
PubChem	12156

M. W.

156.60946

CAS

622-86-6

Similarity

N/A

ID: 92303

3-[(5-amino-2-chlorophenyl)amino]-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyraz...

$$$$ Data

M. F.

C15H10Cl4N4O

Suppliers	Catalog Number
Apollo Scientific	OR8827
Bide Pharmatech	BD6166

Database	Data ID
PubChem	104488

M. W.

404.0781

CAS

53411-33-9

Similarity

N/A

ID: 92304

4-aminophenol

$$$$ Data More

M. F.

C6H7NO

Suppliers	Catalog Number
Sigma Aldrich	60034 245992 A71328 (more...)
MP Biomedicals	05204138
Alfa Aesar	A13581

Database	Data ID
Wikipedia	4-Aminophenol
PubChem	403

M. W.

109.12588

CAS

123-30-8

Similarity

N/A

ID: 92305

1-chloro-4-(trichloromethyl)benzene

$$$$ Data More

M. F.

C7H4Cl4

Suppliers	Catalog Number
Sigma Aldrich	C25805 45997
Alfa Aesar	B23446
Apollo Scientific	OR8829

Database	Data ID
PubChem	21277

M. W.

229.91866

CAS

5216-25-1

Similarity

N/A

ID: 92306

4-chlorophenol

$$$$ Data More

M. F.

C6H5ClO

Suppliers	Catalog Number
Sigma Aldrich	C62816 185787 25865 (more...)
MP Biomedicals	05205596
Alfa Aesar	A15602

Database	Data ID
PubChem	4684

M. W.

128.5563

CAS

106-48-9

Similarity

N/A

ID: 92307

morpholine-4-carbonyl chloride

$$$$ Data

M. F.

C5H8ClNO2

Suppliers	Catalog Number
Sigma Aldrich	348295
Apollo Scientific	OR8831
InterBioScreen	BB_SC-6435

Database	Data ID
PubChem	84810

M. W.

149.57552

CAS

15159-40-7

Similarity

N/A

ID: 92308

2-bromo-1,3,5-trichlorobenzene

$$$$ Data

M. F.

C6H2BrCl3

Suppliers	Catalog Number
Alfa Aesar	B25000
Maybridge	TL00687
Apollo Scientific	OR8833

Database	Data ID
PubChem	140526

M. W.

260.34308

CAS

19393-96-5

Similarity

N/A

ID: 92309

2-(pyridin-4-yl)ethane-1-sulfonic acid

$$$$ Data More

M. F.

C7H9NO3S

Suppliers	Catalog Number
Sigma Aldrich	142425 82905
MP Biomedicals	05221493
Alfa Aesar	L11906

Database	Data ID
PubChem	96722

M. W.

187.21626

CAS

53054-76-5

Similarity

N/A

ID: 92310

10H-phenothiazine-10-carbonyl chloride

$$$$ Data

M. F.

C13H8ClNOS

Suppliers	Catalog Number
Apollo Scientific	OR8835
InterBioScreen	BB_SC-5369

Database	Data ID
PubChem	87864

M. W.

261.72672

CAS

Similarity

N/A

ID: 92311

benzyl chloroformate

$$$$ Data More

M. F.

C8H7ClO2

Suppliers	Catalog Number
Sigma Aldrich	119938 23162
Alfa Aesar	A15682
Apollo Scientific	OR8836

Database	Data ID
Wikipedia	Benzyl_chloroformate
PubChem	10387

M. W.

170.59298

CAS

501-53-1

Similarity

N/A

ID: 92312

1-chlorodecane

$$$$ Data More

M. F.

C10H21Cl

Suppliers	Catalog Number
Sigma Aldrich	C32909 24205
MP Biomedicals	05221709
Apollo Scientific	OR8837

Database	Data ID
PubChem	13848

M. W.

176.72674

CAS

1002-69-3

Similarity

N/A

ID: 92313

hexanoyl chloride

$$$$ Data

M. F.

C6H11ClO

Suppliers	Catalog Number
Sigma Aldrich	294659 156957 21590
Alfa Aesar	B23027
Apollo Scientific	OR8839

Database	Data ID
PubChem	67340

M. W.

134.60394

CAS

142-61-0

Similarity

N/A

ID: 92314

propanedinitrile

$$$$ Data More

M. F.

C3H2N2

Suppliers	Catalog Number
Sigma Aldrich	690414 M1407
MP Biomedicals	02102240 05201071
Alfa Aesar	A15046

Database	Data ID
Wikipedia	Malononitrile
PubChem	8010

M. W.

66.06138

CAS

109-77-3

Similarity

N/A

ID: 92315

methyl 3-chlorobenzoate

$$$$ Data More

M. F.

C8H7ClO2

Suppliers	Catalog Number
Sigma Aldrich	234621
Alfa Aesar	B21371
Apollo Scientific	OR8843

Database	Data ID
PubChem	17946

M. W.

170.59298

CAS

2905-65-9

Similarity

N/A

ID: 92316

2-methylbenzonitrile

$$$$ Data More

M. F.

C8H7N

Suppliers	Catalog Number
Sigma Aldrich	119776 89660
Alfa Aesar	B22231
Apollo Scientific	OR8844

Database	Data ID
PubChem	10721

M. W.

117.14788

CAS

529-19-1

Similarity

N/A

ID: 92317

methyl 3-chloro-3-oxopropanoate

$$$$ Data

M. F.

C4H5ClO3

Suppliers	Catalog Number
Sigma Aldrich	164011 63406
Alfa Aesar	20823
Apollo Scientific	OR8845

Database	Data ID
PubChem	123460

M. W.

136.5337

CAS

37517-81-0

Similarity

N/A

ID: 92318

4-hydrazinyl-3-nitropyridine

$$$$ Data

M. F.

C5H6N4O2

Suppliers	Catalog Number
Apollo Scientific	OR8847
A&J Pharmtech	AJA-O2496

Database	Data ID
PubChem	4204463

M. W.

154.12674

CAS

33544-42-2

Similarity

N/A

ID: 92319

5-methoxypyridine-2-carbonitrile

$$$$ Data

M. F.

C7H6N2O

Suppliers	Catalog Number
Apollo Scientific	OR8848
A&J Pharmtech	AJA-O24573

Database	Data ID
PubChem	13144279

M. W.

134.13534

CAS

89809-63-2

Similarity

N/A

ID: 92320

2-amino-3-[7-(benzyloxy)-1H-indol-3-yl]propanoic acid

$$$$ Data More

M. F.

C18H18N2O3

Suppliers	Catalog Number
Sigma Aldrich	B2501
MP Biomedicals	02154848
Apollo Scientific	OR8850T

Database	Data ID
PubChem	2735505

M. W.

310.34712

CAS

66866-40-8

Similarity

N/A

ID: 92321

{[7-(bromomethyl)-2,6-dimethyl-3,5-dioxo-3H,5H-[1,2]diazolo[1,2-a]pyrazol-1-yl]m...

$$$$ Data

M. F.

C13H19Br2N3O2

Suppliers	Catalog Number
Sigma Aldrich	71028
Apollo Scientific	OR8851T
TRC	B688500

Database	Data ID
PubChem	474473

M. W.

409.11686

CAS

71418-45-6

Similarity

N/A

ID: 92322

1-(4-methoxyphenyl)propan-1-one

$$$$ Data More

M. F.

C10H12O2

Suppliers	Catalog Number
Sigma Aldrich	M24809
MP Biomedicals	05206491
Alfa Aesar	A14619

Database	Data ID
PubChem	67144

M. W.

164.20108

CAS

121-97-1

Similarity

N/A

ID: 92323

methyl 2,5-dibromopentanoate

$$$$ Data

M. F.

C6H10Br2O2

Suppliers	Catalog Number
Apollo Scientific	OR8857

Database	Data ID
PubChem	10912698

M. W.

273.9504

CAS

50995-48-7

Similarity

N/A

ID: 92324

methyl cyclohex-1-ene-1-carboxylate

$$$$ Data

M. F.

C8H12O2

Suppliers	Catalog Number
Sigma Aldrich	232181 29253
Alfa Aesar	B25568
Apollo Scientific	OR8858

Database	Data ID
PubChem	87647

M. W.

140.17968

CAS

18448-47-0

Similarity

N/A

ID: 92325

oct-1-yn-3-ol

$$$$ Data More

M. F.

C8H14O

Suppliers	Catalog Number
Sigma Aldrich	127280 74973
MP Biomedicals	05225421
Apollo Scientific	OR8859

Database	Data ID
PubChem	13166

M. W.

126.19616

CAS

818-72-4

Similarity

N/A

ID: 92326

hexane-2,5-dione

$$$$ Data More

M. F.

C6H10O2

Suppliers	Catalog Number
Sigma Aldrich	165131 A10604 10890 (more...)
MP Biomedicals	05205404
Alfa Aesar	B25686

Database	Data ID
Wikipedia	Hexane-2,5-dione
PubChem	8035

M. W.

114.1424

CAS

110-13-4

Similarity

N/A

ID: 92327

(quinolin-2-yl)boronic acid

$$$$ Data

M. F.

C9H8BNO2

Suppliers	Catalog Number
Apollo Scientific	OR8861
A&J Pharmtech	AJA-O34613

Database	Data ID
PubChem	22173501

M. W.

172.97632

CAS

745784-12-7

Similarity

N/A

ID: 92328

tert-butyl 5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole-1-carboxylate

$$$$ Data

M. F.

C18H25BN2O4

Suppliers	Catalog Number
Maybridge	CC53239
Apollo Scientific	OR8862
Bide Pharmatech	BD152949

Database	Data ID
PubChem	18525862

M. W.

344.2131

CAS

864771-44-8

Similarity

N/A

ID: 92329

3-bromo-2-methylbenzoyl chloride

$$$$ Data

M. F.

C8H6BrClO

Suppliers	Catalog Number
Apollo Scientific	OR8865

Database	Data ID
PubChem	19367807

M. W.

233.48964

CAS

21900-48-1

Similarity

N/A

ID: 92330

(2,3,4-trichlorophenyl)boronic acid

$$$$ Data

M. F.

C6H4BCl3O2

Suppliers	Catalog Number
Apollo Scientific	OR8866
A&J Pharmtech	AJA-O34529

Database	Data ID
PubChem	4192673

M. W.

225.26476

CAS

352530-21-3

Similarity

N/A

ID: 92331

(2,3,5-trichlorophenyl)boronic acid

$$$$ Data

M. F.

C6H4BCl3O2

Suppliers	Catalog Number
Alfa Aesar	L17511
Apollo Scientific	OR8867
A&J Pharmtech	AJA-O35156

Database	Data ID
PubChem	5106508

M. W.

225.26476

CAS

212779-19-6

Similarity

N/A

ID: 92332

(3-bromopyridin-4-yl)boronic acid

$$$$ Data

M. F.

C5H5BBrNO2

Suppliers	Catalog Number
Apollo Scientific	OR8872
A&J Pharmtech	AJA-O28797

Database	Data ID
PubChem	23005325

M. W.

201.8137

CAS

458532-99-5

Similarity

N/A

ID: 92333

(propan-2-yl)boronic acid

$$$$ Data More

M. F.

C3H9BO2

Suppliers	Catalog Number
Sigma Aldrich	648787
Alfa Aesar	L19962
Apollo Scientific	OR8880

Database	Data ID
PubChem	2734750

M. W.

87.91336

CAS

80041-89-0

Similarity

N/A

ID: 92334

(3S,4S,5R)-5-[(benzyloxy)methyl]oxolane-2,3,4-triol

$$$$ Data

M. F.

C12H16O5

Suppliers	Catalog Number
Apollo Scientific	OR8880T

Database	Data ID
PubChem	11184046

M. W.

240.25244

CAS

Similarity

N/A

ID: 92335

propan-2-yl 4-methylbenzene-1-sulfonate

$$$$ Data More

M. F.

C10H14O3S

Suppliers	Catalog Number
Apollo Scientific	OR8885
TRC	I873800
Bide Pharmatech	BD12247

Database	Data ID
PubChem	598985

M. W.

214.28136

CAS

2307-69-9

Similarity

N/A

ID: 92336

(3S,4S)-oxolane-3,4-diol

$$$$ Data

M. F.

C4H8O3

Suppliers	Catalog Number
Apollo Scientific	OR8886
TRC	A656400

Database	Data ID
PubChem	641772

M. W.

104.10452

CAS

84709-85-3

Similarity

N/A

ID: 92337

2-bromo-2,3-dihydro-1H-indene-1,3-dione

$$$$ Data

M. F.

C9H5BrO2

Suppliers	Catalog Number
Sigma Aldrich	17358
Apollo Scientific	OR8889

Database	Data ID
PubChem	253820

M. W.

225.0388

CAS

7319-63-3

Similarity

N/A

ID: 92338

1-propylpiperidin-4-one

$$$$ Data More

M. F.

C8H15NO

Suppliers	Catalog Number
Sigma Aldrich	279498
Alfa Aesar	B25477
Apollo Scientific	OR8890

Database	Data ID
PubChem	90006

M. W.

141.2108

CAS

23133-37-1

Similarity

N/A

ID: 92339

N,N-diacetylprop-2-enamide

$$$$ Data

M. F.

C7H9NO3

Suppliers	Catalog Number
Apollo Scientific	OR8891

Database	Data ID
PubChem	13765434

M. W.

155.15126

CAS

Similarity

N/A

ID: 92340

(5-bromo-2-methoxyphenyl)methanol

$$$$ Data More

M. F.

C8H9BrO2

Suppliers	Catalog Number
Sigma Aldrich	189693
Apollo Scientific	OR8893
Chemik	CHB62851

Database	Data ID
PubChem	612298

M. W.

217.05986

CAS

80866-82-6

Similarity

N/A

ID: 92341

3-ethenylpyridine

$$$$ Data

M. F.

C7H7N

Suppliers	Catalog Number
Apollo Scientific	OR8894
TRC	V487500

Database	Data ID
PubChem	14272

M. W.

105.13718

CAS

1121-55-7

Similarity

N/A

ID: 92342

2,4,5-tribromo-1H-imidazole

$$$$ Data More

M. F.

C3HBr3N2

Suppliers	Catalog Number
Sigma Aldrich	141704
Alfa Aesar	L05716
Apollo Scientific	OR8896

Database	Data ID
PubChem	16253

M. W.

304.76544

CAS

2034-22-2

Similarity

N/A

ID: 92343

5-nitropyridine-3-carboxylic acid

$$$$ Data More

M. F.

C6H4N2O4

Suppliers	Catalog Number
Apollo Scientific	OR8897
TRC	N496870
Bide Pharmatech	BD8427

Database	Data ID
PubChem	1514301

M. W.

168.10696

CAS

2047-49-6

Similarity

N/A

ID: 92344

2-(pyridin-4-yl)ethane-1-thiol

$$$$ Data

M. F.

C7H9NS

Suppliers	Catalog Number
Apollo Scientific	OR8898
TRC	P994050

Database	Data ID
PubChem	150969

M. W.

139.21806

CAS

2127-05-1

Similarity

N/A

ID: 92345

2,6-dimethylpyridin-1-ium-1-olate

$$$$ Data More

M. F.

C7H9NO

Suppliers	Catalog Number
MP Biomedicals	05214151
Alfa Aesar	A14299
Apollo Scientific	OR8899

Database	Data ID
PubChem	14083

M. W.

123.15246

CAS

1073-23-0

Similarity

N/A

ID: 92346

2-methoxybenzene-1,4-diol

$$$$ Data More

M. F.

C7H8O3

Suppliers	Catalog Number
Sigma Aldrich	176893
Alfa Aesar	A12847
Apollo Scientific	OR8900

Database	Data ID
PubChem	69988

M. W.

140.13662

CAS

824-46-4

Similarity

N/A

ID: 92347

(2S)-2-methylpyrrolidine-2-carboxylic acid

$$$$ Data

M. F.

C6H11NO2

Suppliers	Catalog Number
Sigma Aldrich	17249
Apollo Scientific	OR8903
Bide Pharmatech	BD224213

Database	Data ID
PubChem	6993664

M. W.

129.15704

CAS

42856-71-3

Similarity

N/A

ID: 92348

3-benzylpyridine

$$$$ Data

M. F.

C12H11N

Suppliers	Catalog Number
Apollo Scientific	OR8904

Database	Data ID
PubChem	12112

M. W.

169.22244

CAS

Similarity

N/A

ID: 92349

3-(bromomethyl)phenyl acetate

$$$$ Data

M. F.

C9H9BrO2

Suppliers	Catalog Number
Apollo Scientific	OR8905

Database	Data ID
PubChem	6422075

M. W.

229.07056

CAS

Similarity

N/A

ID: 92350

2-butyl-2-(hydroxymethyl)hexanoic acid

$$$$ Data

M. F.

C11H22O3

Suppliers	Catalog Number
Apollo Scientific	OR8908

Database	Data ID
PubChem	22728740

M. W.

202.29058

CAS

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified