(±)-Alanine methyl ester hydrochloride
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 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
13515-97-4SMILES
COC(=O)C(C)N.ClInChIKey
IYUKFAFDFHZKPI-UHFFFAOYSA-NInChI
InChI=1S/C4H9NO2.ClH/c1-3(5)4(6)7-2;/h3H,5H2,1-2H3;1HWeigh 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
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.
Similar compounds
L-Alanine isopropyl ester hydrochloride39825-33-762 % similar
L-Alanine isopropyl ester hydrochloride62062-65-162 % similar
Methyl D-valinate hydrochloride21685-47-260 % similar
Methyl DL-valinate hydrochloride5619-05-660 % similar
Methyl L-valinate hydrochloride6306-52-160 % similar
Methyl D-valinate hydrochloride7146-15-860 % similar
(S)-Alanine ethyl ester hydrochloride1115-59-958 % similar
tert-Butyl alaninate hydrochloride13404-22-358 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.