(s)-2-Aminobutanoic acid hydrochloride

C4H10ClNO2CAS 5959-29-5139.58 g/mol

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OOHNH2HCl
Carboxylic acidPrimary amine

Properties

Molecular formula
C4H10ClNO2
Molar mass
139.58 g/mol
Exact mass
139.0400 Da
logP
0.23Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
5959-29-5
SMILES
CC[C@@H](C(=O)O)N.Cl
InChIKey
AMMBUJFMJOQABC-DFWYDOINSA-N
InChI
InChI=1S/C4H9NO2.ClH/c1-2-3(5)4(6)7;/h3H,2,5H2,1H3,(H,6,7);1H/t3-;/m0./s1

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Names and synonyms

1 names
  • L-2-Aminobutyric acid hydrochloride

Work with (s)-2-Aminobutanoic acid hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

α-Aminobutyric acid2835-81-6Free base, stereo not defined α-Aminobutyric acid80-60-4Free base, stereo not defined D-Alpha-aminobutyric acid2623-91-8Free base, enantiomer (+)-α-Aminobutyric acid1492-24-6Free base

Similar compounds

(S)-(+)-2,3-Diaminopropionic acid hydrochloride1482-97-962 % similar DL-2,3-Diaminopropionic acid hydrochloride54897-59-562 % similar DL-2,3-Diaminopropionic acid hydrochloride6018-55-962 % similar (R)-(-)-2,3-Diaminopropionic acid hydrochloride6018-56-062 % similar (±)-Cysteine hydrochloride10318-18-060 % similar Cystine dihydrochloride30925-07-660 % similar D-Cysteine hydrochloride32443-99-560 % similar L-Cystine, hydrochloride (1:?)34760-60-660 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Methyl sarcosinate hydrochloride13515-93-0 (±)-Alanine methyl ester hydrochloride13515-97-4 (R)-2-Aminopropionic acid methyl ester hydrochloride14316-06-4 cis-3,4-Dihydroxypyrrolid...186393-21-5 Dimethylglycine hydrochloride2491-06-7 Alanine methyl ester hydrochloride2491-20-5 Methyl 3-aminopropionate hydrochloride3196-73-4 L-Beta-homoalanine hydrochloride58610-41-6

Elsewhere

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