(S)-2-Aminobutyramide hydrochloride

C₄H₁₁ClN₂OCAS 7682-20-4138.59 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₄H₁₁ClN₂O
Molar mass: 138.59 g/mol
Exact mass: 138.0560 Da
logP: 0.68Crippen estimate
Polar surface area: 70.1 Å²
H-bond donors / acceptors: 3 / 2
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

7682-20-4

SMILES

CC[C@H](N)C(=N)O.Cl

InChIKey

HDBMIDJFXOYCGK-DFWYDOINSA-N

InChI

InChI=1S/C4H10N2O.ClH/c1-2-3(5)4(6)7;/h3H,2,5H2,1H3,(H2,6,7);1H/t3-;/m0./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names

Butanamide, 2-amino-, hydrochloride (1:1), (2S)-
Butyramide, 2-amino-, monohydrochloride, L-
Butanamide, 2-amino-, monohydrochloride, (S)-
Butanamide, 2-amino-, monohydrochloride, (2S)-
(S)-(+)-2-Aminobutanamide hydrochloride
(S)-2-Aminobutanamide hydrochloride
(2S)-2-Aminobutanamide hydrochloride

Work with (S)-2-Aminobutyramide 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.

(2S)-2-Aminobutyramide143164-46-9Free base

Similar compounds

L-Serinamide hydrochloride65414-74-662 % similar Leucinamide hydrochloride10466-61-261 % similar (s)-2-Aminobutanoic acid hydrochloride5959-29-555 % similar L-Alaninamide hydrochloride33208-99-050 % similar (+)-α-Aminobutyric acid1492-24-645 % similar D-Alpha-aminobutyric acid2623-91-845 % similar α-Aminobutyric acid2835-81-645 % similar α-Aminobutyric acid80-60-445 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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