(±)-Alanine methyl ester hydrochloride

C₄H₁₀ClNO₂CAS 13515-97-4139.58 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: 155–157 °C
logP: -0.07Crippen estimate
Polar surface area: 52.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

13515-97-4

SMILES

COC(=O)C(C)N.Cl

InChIKey

IYUKFAFDFHZKPI-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

7 names

Alanine, methyl ester, hydrochloride (1:1)
Alanine, methyl ester, hydrochloride, DL-
DL-Alanine, methyl ester, hydrochloride
Alanine, methyl ester, hydrochloride
Methyl DL-alaninate hydrochloride
Methyl 2-aminopropanoate hydrochloride
DL-Alanine methyl ester hydrochloride

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 (R)-2-Aminopropionic acid methyl ester hydrochloride14316-06-4 Dimethylglycine hydrochloride2491-06-7 Alanine methyl ester hydrochloride2491-20-5 Glycine ethyl ester hydrochloride623-33-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook