Chembase list of 866358 unique molecular structures

4-[difluoro(phenyl)methyl]-1,2-dimethylbenzene

$$$$ Data

M. F.

C15H14F2

Suppliers	Catalog Number
Apollo Scientific	PC49552

Database	Data ID
PubChem	53435200

M. W.

232.2684664

CAS

Similarity

N/A

ID: 97902

1-chloro-4-(2,2,2-trifluoroethyl)benzene

$$$$ Data

M. F.

C8H6ClF3

Suppliers	Catalog Number
Apollo Scientific	PC49553

Database	Data ID
PubChem	45790963

M. W.

194.5814496

CAS

81577-07-3

Similarity

N/A

ID: 97903

1-(2,2,2-trifluoroethyl)naphthalene

$$$$ Data

M. F.

C12H9F3

Suppliers	Catalog Number
Apollo Scientific	PC49554

Database	Data ID
PubChem	14297327

M. W.

210.1950696

CAS

123228-02-4

Similarity

N/A

ID: 97904

(2,2-difluorocyclohexyl)benzene

$$$$ Data

M. F.

C12H14F2

Suppliers	Catalog Number
Apollo Scientific	PC49555

Database	Data ID
PubChem	45790565

M. W.

196.2363664

CAS

57514-11-1

Similarity

N/A

ID: 97905

1-chloro-3-(2,2,2-trifluoroethyl)benzene

$$$$ Data

M. F.

C8H6ClF3

Suppliers	Catalog Number
Apollo Scientific	PC49556

Database	Data ID
PubChem	22134639

M. W.

194.5814496

CAS

81577-09-5

Similarity

N/A

ID: 97906

1-(1,1-difluoroethyl)-4-methylbenzene

$$$$ Data

M. F.

C9H10F2

Suppliers	Catalog Number
Apollo Scientific	PC49557

Database	Data ID
PubChem	45790975

M. W.

156.1725064

CAS

Similarity

N/A

ID: 97907

1-chloro-4-(1,1-difluoroethyl)-2-methylbenzene

$$$$ Data

M. F.

C9H9ClF2

Suppliers	Catalog Number
Apollo Scientific	PC49558

Database	Data ID
PubChem	45790993

M. W.

190.6175664

CAS

Similarity

N/A

ID: 97908

1-(1,1-difluoroethyl)-3-methylbenzene

$$$$ Data

M. F.

C9H10F2

Suppliers	Catalog Number
Apollo Scientific	PC49559

Database	Data ID
PubChem	45790976

M. W.

156.1725064

CAS

Similarity

N/A

ID: 97909

1-chloro-4-(1,1,1-trifluoropropan-2-yl)benzene

$$$$ Data

M. F.

C9H8ClF3

Suppliers	Catalog Number
Apollo Scientific	PC49560

Database	Data ID
PubChem	45790965

M. W.

208.6080296

CAS

Similarity

N/A

ID: 97910

1-tert-butyl-4-(trifluoromethyl)benzene

$$$$ Data

M. F.

C11H13F3

Suppliers	Catalog Number
Apollo Scientific	PC49561

Database	Data ID
PubChem	12070544

M. W.

202.2161296

CAS

Similarity

N/A

ID: 97911

2,4-dichloro-1-(1,1-difluoroethyl)benzene

$$$$ Data

M. F.

C8H6Cl2F2

Suppliers	Catalog Number
Apollo Scientific	PC49562

Database	Data ID
PubChem	45790999

M. W.

211.0360464

CAS

Similarity

N/A

ID: 97912

4-[difluoro(phenyl)methyl]-1,2-difluorobenzene

$$$$ Data

M. F.

C13H8F4

Suppliers	Catalog Number
Apollo Scientific	PC49563

Database	Data ID
PubChem	53435199

M. W.

240.1962328

CAS

Similarity

N/A

ID: 97913

(2,2-difluoroethyl)benzene

$$$$ Data

M. F.

C8H8F2

Suppliers	Catalog Number
Apollo Scientific	PC49564

Database	Data ID
PubChem	422220

M. W.

142.1459264

CAS

10541-59-0

Similarity

N/A

ID: 97914

(1,1-difluoro-2-methylpropyl)benzene

$$$$ Data

M. F.

C10H12F2

Suppliers	Catalog Number
Apollo Scientific	PC49565

Database	Data ID
PubChem	45790981

M. W.

170.1990864

CAS

Similarity

N/A

ID: 97915

9-(1,1-difluoroethyl)anthracene

$$$$ Data

M. F.

C16H12F2

Suppliers	Catalog Number
Apollo Scientific	PC49566

Database	Data ID
PubChem	54772272

M. W.

242.2632864

CAS

Similarity

N/A

ID: 97916

(1,1-difluorobutyl)benzene

$$$$ Data

M. F.

C10H12F2

Suppliers	Catalog Number
Apollo Scientific	PC49567

Database	Data ID
PubChem	45790982

M. W.

170.1990864

CAS

Similarity

N/A

ID: 97917

1-phenyl-4-(2,2,2-trifluoroethyl)benzene

$$$$ Data

M. F.

C14H11F3

Suppliers	Catalog Number
Apollo Scientific	PC49568

Database	Data ID
PubChem	45790968

M. W.

236.2323496

CAS

Similarity

N/A

ID: 97918

4-(1,1-difluoroethyl)-1,2-dimethylbenzene

$$$$ Data

M. F.

C10H12F2

Suppliers	Catalog Number
Apollo Scientific	PC49569

Database	Data ID
PubChem	45790983

M. W.

170.1990864

CAS

Similarity

N/A

ID: 97919

2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)ethan-1-amine

$$$$ Data

M. F.

C10H12F3NS

Suppliers	Catalog Number
Apollo Scientific	PC4957

Database	Data ID
PubChem	2777475

M. W.

235.2691896

CAS

Similarity

N/A

ID: 97920

1-(1,1-difluoroethyl)-4-ethylbenzene

$$$$ Data

M. F.

C10H12F2

Suppliers	Catalog Number
Apollo Scientific	PC49570

Database	Data ID
PubChem	18739961

M. W.

170.1990864

CAS

Similarity

N/A

ID: 97921

1,3-dichloro-2-fluoro-4-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H2Cl2F4

Suppliers	Catalog Number
Apollo Scientific	PC49571

Database	Data ID
PubChem	54772266

M. W.

232.9903928

CAS

Similarity

N/A

ID: 97922

1-fluoro-4-methyl-2-(trifluoromethyl)benzene

$$$$ Data

M. F.

C8H6F4

Suppliers	Catalog Number
Apollo Scientific	PC49572

Database	Data ID
PubChem	17953537

M. W.

178.1268528

CAS

1214385-64-4

Similarity

N/A

ID: 97923

1,2,4-trifluoro-3-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H2F6

Suppliers	Catalog Number
Apollo Scientific	PC49573

Database	Data ID
PubChem	14366551

M. W.

200.0811992

CAS

122030-02-8

Similarity

N/A

ID: 97924

2-methyl-1-(trifluoromethyl)naphthalene

$$$$ Data

M. F.

C12H9F3

Suppliers	Catalog Number
Apollo Scientific	PC49574

Database	Data ID
PubChem	12476064

M. W.

210.1950696

CAS

70109-82-9

Similarity

N/A

ID: 97925

1,5-dichloro-2-fluoro-4-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H2Cl2F4

Suppliers	Catalog Number
Apollo Scientific	PC49575

Database	Data ID
PubChem	13938035

M. W.

232.9903928

CAS

112290-01-4

Similarity

N/A

ID: 97926

1-(bromomethyl)-4-(2,2,2-trifluoroethyl)benzene

$$$$ Data

M. F.

C9H8BrF3

Suppliers	Catalog Number
Apollo Scientific	PC49576

Database	Data ID
PubChem	54772255

M. W.

253.0590296

CAS

Similarity

N/A

ID: 97927

1,2,5-trifluoro-3-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H2F6

Suppliers	Catalog Number
Apollo Scientific	PC49577

Database	Data ID
PubChem	223093

M. W.

200.0811992

CAS

392-91-6

Similarity

N/A

ID: 97928

1,2-dichloro-3,4-bis(trifluoromethyl)benzene

$$$$ Data

M. F.

C8H2Cl2F6

Suppliers	Catalog Number
Apollo Scientific	PC49578

Database	Data ID
PubChem	54772251

M. W.

282.9978992

CAS

Similarity

N/A

ID: 97929

1,2-dichloro-4-fluoro-3-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H2Cl2F4

Suppliers	Catalog Number
Apollo Scientific	PC49579

Database	Data ID
PubChem	54772252

M. W.

232.9903928

CAS

Similarity

N/A

ID: 97930

2-chloro-1,3-difluorobenzene

$$$$ Data

M. F.

C6H3ClF2

Suppliers	Catalog Number
Apollo Scientific	PC4958
Chemik	CHB55600

Database	Data ID
PubChem	142257

M. W.

148.5378264

CAS

38361-37-4

Similarity

N/A

ID: 97931

1,4-dichloro-2-fluoro-3-(trifluoromethyl)benzene

$$$$ Data

M. F.

C7H2Cl2F4

Suppliers	Catalog Number
Apollo Scientific	PC49580

Database	Data ID
PubChem	54772260

M. W.

232.9903928

CAS

Similarity

N/A

ID: 97932

2-fluoro-1,3-dimethyl-5-(trifluoromethyl)benzene

$$$$ Data

M. F.

C9H8F4

Suppliers	Catalog Number
Apollo Scientific	PC49581

Database	Data ID
PubChem	53435084

M. W.

192.1534328

CAS

Similarity

N/A

ID: 97933

1,2-dichloro-4-(1,1-difluoroethyl)benzene

$$$$ Data

M. F.

C8H6Cl2F2

Suppliers	Catalog Number
Apollo Scientific	PC49582

Database	Data ID
PubChem	45790998

M. W.

211.0360464

CAS

Similarity

N/A

ID: 97934

1-chloro-4-[difluoro(phenyl)methyl]benzene

$$$$ Data

M. F.

C13H9ClF2

Suppliers	Catalog Number
Apollo Scientific	PC49583

Database	Data ID
PubChem	15643484

M. W.

238.6603664

CAS

Similarity

N/A

ID: 97935

1-chloro-4-(1,1,1-trifluoro-3-methylbutan-2-yl)benzene

$$$$ Data

M. F.

C11H12ClF3

Suppliers	Catalog Number
Apollo Scientific	PC49585

Database	Data ID
PubChem	45790969

M. W.

236.6611896

CAS

Similarity

N/A

ID: 97936

2-(1,1-difluoroethyl)-1,4-dimethylbenzene

$$$$ Data

M. F.

C10H12F2

Suppliers	Catalog Number
Apollo Scientific	PC49586

Database	Data ID
PubChem	45790980

M. W.

170.1990864

CAS

Similarity

N/A

ID: 97937

2,3,5,6-tetrafluoro-N,N-dimethyl-4-(trifluoromethyl)aniline

$$$$ Data

M. F.

C9H6F7N

Suppliers	Catalog Number
Apollo Scientific	PC4959

Database	Data ID
PubChem	2782522

M. W.

261.1394624

CAS

28012-10-4

Similarity

N/A

ID: 97938

lanthanum(3+) ion trifluoride

$$$$ Data

M. F.

F3La

Suppliers	Catalog Number
Alfa Aesar	41414 A16673 14061 (more...)
Apollo Scientific	PC4960

Database	Data ID
PubChem	9837037

M. W.

195.9007096

CAS

13709-38-1

Similarity

N/A

ID: 97939

1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-8-(prop-2-en-1-yloxy)octane

$$$$ Data

M. F.

C11H9F13O

Suppliers	Catalog Number
Apollo Scientific	PC4961

Database	Data ID
PubChem	13570053

M. W.

404.1678016

CAS

Similarity

N/A

ID: 97940

lanthanum(3+) ion tritrifluoromethanesulfonate

$$$$ Data

M. F.

C3F9LaO9S3

Suppliers	Catalog Number
Sigma Aldrich	430609 61560
Alfa Aesar	L19657
Apollo Scientific	PC4963

Database	Data ID
PubChem	2733938

M. W.

586.1128288

CAS

52093-26-2

Similarity

N/A

ID: 97941

methyl 2-bromo-4,5-difluorobenzoate

$$$$ Data

M. F.

C8H5BrF2O2

Suppliers	Catalog Number
Apollo Scientific	PC4964
Chemik	CHB39461

Database	Data ID
PubChem	26985845

M. W.

251.0249064

CAS

878207-28-4

Similarity

N/A

ID: 97942

4-bromo-3,5-difluorobenzene-1-sulfonyl chloride

$$$$ Data

M. F.

C6H2BrClF2O2S

Suppliers	Catalog Number
Apollo Scientific	PC4965
Chemik	CHB66531

Database	Data ID
PubChem	44717516

M. W.

291.4976864

CAS

518057-63-1

Similarity

N/A

ID: 97943

ethyl 2-bromo-4,5-difluorobenzoate

$$$$ Data

M. F.

C9H7BrF2O2

Suppliers	Catalog Number
Apollo Scientific	PC4966

Database	Data ID
PubChem	26985847

M. W.

265.0514864

CAS

Similarity

N/A

ID: 97944

methyl 2-fluoroprop-2-enoate

$$$$ Data

M. F.

C4H5FO2

Suppliers	Catalog Number
Apollo Scientific	PC4967
Bide Pharmatech	BD138282

Database	Data ID
PubChem	2782524

M. W.

104.0797032

CAS

2343-89-7

Similarity

N/A

ID: 97945

2,2,3,3,4,4,4-heptafluorobutyl 2-fluoroprop-2-enoate

$$$$ Data

M. F.

C7H4F8O2

Suppliers	Catalog Number
Apollo Scientific	PC4968

Database	Data ID
PubChem	2782525

M. W.

272.0926856

CAS

Similarity

N/A

ID: 97946

2,2,3,3,3-pentafluoropropyl 2-fluoroprop-2-enoate

$$$$ Data

M. F.

C6H4F6O2

Suppliers	Catalog Number
Apollo Scientific	PC4969

Database	Data ID
PubChem	2782526

M. W.

222.0851792

CAS

96250-35-0

Similarity

N/A

ID: 97947

4-fluorobenzene-1,3-diamine hydrochloride

$$$$ Data

M. F.

C6H8ClFN2

Suppliers	Catalog Number
Apollo Scientific	PC4970

Database	Data ID
PubChem	45933651

M. W.

162.5925232

CAS

Similarity

N/A

ID: 97948

2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl 2-fluoroprop-2-enoate

$$$$ Data

M. F.

C10H5F13O2

Suppliers	Catalog Number
Apollo Scientific	PC4971

Database	Data ID
PubChem	2782527

M. W.

404.1247416

CAS

119986-76-4

Similarity

N/A

ID: 97949

2,2,3,3,4,4,5,5-octafluoropentyl 2-fluoroprop-2-enoate

$$$$ Data

M. F.

C8H5F9O2

Suppliers	Catalog Number
Apollo Scientific	PC4972

Database	Data ID
PubChem	2782528

M. W.

304.1097288

CAS

87910-92-7

Similarity

N/A

ID: 97950

2,2,3,3-tetrafluoropropyl 2-fluoroprop-2-enoate

$$$$ Data

M. F.

C6H5F5O2

Suppliers	Catalog Number
Apollo Scientific	PC4973

Database	Data ID
PubChem	2782529

M. W.

204.094716

CAS

96250-37-2

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