chempirical

H-Beta-ala-nh2 hcl

C3H9ClN2OCAS 64017-81-8124.57 g/mol

Open in Covalent MOL file
H2NONH2HCl
AmidePrimary amine

Properties

Molecular formula
C3H9ClN2O
Molar mass
124.57 g/mol
Exact mass
124.0403 Da
logP
-0.76Crippen estimate
Polar surface area
69.1 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
64017-81-8
SMILES
C(CN)C(=O)N.Cl
InChIKey
GAGJMOQGABUOBK-UHFFFAOYSA-N
InChI
InChI=1S/C3H8N2O.ClH/c4-2-1-3(5)6;/h1-2,4H2,(H2,5,6);1H

Weigh it out

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Names and synonyms

1 names
  • 3-Aminopropanamide hydrochloride

Work with H-Beta-ala-nh2 hcl

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

Similar compounds

Methyl 3-aminopropionate hydrochloride3196-73-446 % similar 3-Aminopropionic acid ethyl ester hydrochloride4244-84-243 % similar Ethylenediamine hydrochloride18299-54-242 % similar Ethylenediamine hydrochloride333-18-642 % similar H-Beta-ala-otbu hcl58620-93-242 % similar 5-Aminovaleric acid hydrochloride627-95-241 % similar H-Lys-nh2 2hcl51127-08-341 % similar β-Alanine107-95-940 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

L-Alaninamide hydrochloride33208-99-0 H-Gly-nhme hcl49755-94-4 (2R)-2-Aminopropanamide hydrochloride71810-97-4

Elsewhere

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