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14975-30-5 molecular structure
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(2S)-2-amino-5-carbamimidamidopentanamide hydrochloride

ChemBase ID: 155287
Molecular Formular: C6H16ClN5O
Molecular Mass: 209.67714
Monoisotopic Mass: 209.10433784
SMILES and InChIs

SMILES:
C(C[C@@H](C(=O)N)N)CNC(=N)N.Cl
Canonical SMILES:
NC(=N)NCCC[C@@H](C(=O)N)N.Cl
InChI:
InChI=1S/C6H15N5O.ClH/c7-4(5(8)12)2-1-3-11-6(9)10;/h4H,1-3,7H2,(H2,8,12)(H4,9,10,11);1H/t4-;/m0./s1
InChIKey:
BPQLYFCEVVKLLX-WCCKRBBISA-N

Cite this record

CBID:155287 http://www.chembase.cn/molecule-155287.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2S)-2-amino-5-carbamimidamidopentanamide hydrochloride
IUPAC Traditional name
(2S)-2-amino-5-carbamimidamidopentanamide hydrochloride
Synonyms
L-Argininamide dihydrochloride
CAS Number
14975-30-5
MDL Number
MFCD00058286
PubChem SID
24890827
162249425
PubChem CID
16218903

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
A3913 external link Add to cart Please log in.
Data Source Data ID
PubChem 16218903 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 16.3105  H Acceptors
H Donor LogD (pH = 5.5) -7.136367 
LogD (pH = 7.4) -5.4431906  Log P -2.2958941 
Molar Refractivity 55.7453 cm3 Polarizability 17.561668 Å3
Polar Surface Area 131.01 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Toxic Toxic (T) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
1 expand Show data source
Risk Statements
20/21/22-39/23/24/25 expand Show data source
Safety Statements
36/37 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS08 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H302-H370 expand Show data source
GHS Precautionary statements
P260-P307 + P311 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges expand Show data source
Storage Temperature
-20°C expand Show data source
Empirical Formula (Hill Notation)
C6H15N5O · 2HCl expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - A3913 external link
Biochem/physiol Actions
L-Argininamide (L-Arm) is used as a model compound in studies of the physicochemical characteristic of ligand binding DNA aptamers and their potential development as fluorescent aptasensors.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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