Alanine methyl ester hydrochloride

C₄H₁₀ClNO₂CAS 2491-20-5139.58 g/mol

Open in Covalent MOL file

Ester Halogen Primary Amine

Properties

Molecular formula: C₄H₁₀ClNO₂
Molar mass: 139.58 g/mol
Exact mass: 139.0400 Da
Melting point: 108 °C
logP: -0.07Crippen estimate
Polar surface area: 52.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

2491-20-5

SMILES

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

InChIKey

IYUKFAFDFHZKPI-DFWYDOINSA-N

InChI

InChI=1S/C4H9NO2.ClH/c1-3(5)4(6)7-2;/h3H,5H2,1-2H3;1H/t3-;/m0./s1

Weigh it out

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

Names and synonyms

13 names · show all

L-Alanine, methyl ester, hydrochloride (1:1)
Alanine, methyl ester, hydrochloride, L-
L-Alanine, methyl ester, hydrochloride
Methyl L-alaninate hydrochloride
(S)-Alanine methyl ester hydrochloride
Methyl alaninate hydrochloride
L-Alanine methyl ester hydrochloride salt
(S)-2-Aminopropionic acid methyl ester hydrochloride
NSC 29729
Methyl (S)-2-aminopropanoate hydrochloride
(L)-Ala-OMe hydrochloride
L-Alanine methyl ester hydrogen chloride
Methyl (2S)-2-aminopropanoate hydrochloric acid

Work with Alanine methyl ester 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

Same formula

Methyl sarcosinate hydrochloride13515-93-0 (±)-Alanine methyl ester hydrochloride13515-97-4 (R)-2-Aminopropionic acid methyl ester hydrochloride14316-06-4 Dimethylglycine hydrochloride2491-06-7 Glycine ethyl ester hydrochloride623-33-6

Elsewhere

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