L-Alanine isopropyl ester hydrochloride
Properties
- Molecular formula
- C6H14ClNO2
- Molar mass
- 167.63 g/mol
- Exact mass
- 167.0713 Da
- logP
- 0.71Crippen estimate
- Polar surface area
- 52.3 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 2
- Stereocentres
- Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
39825-33-7SMILES
C[C@@H](C(=O)OC(C)C)N.ClInChIKey
YAQKNCSWDMGPOY-JEDNCBNOSA-NInChI
InChI=1S/C6H13NO2.ClH/c1-4(2)9-6(8)5(3)7;/h4-5H,7H2,1-3H3;1H/t5-;/m0./s1Weigh it out
Type any one amount. The others follow from the molar mass.
Work with L-Alanine isopropyl 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
(±)-Alanine methyl ester hydrochloride13515-97-462 % similar
(R)-2-Aminopropionic acid methyl ester hydrochloride14316-06-462 % similar
Alanine methyl ester hydrochloride2491-20-562 % similar
(S)-Alanine ethyl ester hydrochloride1115-59-956 % similar
L-Alanine tert-butyl ester hydrochloride13404-22-356 % similar
D-Alanine tert-butyl ester hydrochloride59531-86-156 % similar
DL-α-Alanine ethyl ester hydrochloride617-27-656 % similar
H-D-Ala-oet hcl6331-09-556 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds
Same formula
Ethyl α-aminoisobutyrate hydrochloride17288-15-2
Methyl D-valinate hydrochloride21685-47-2
Glycine tert-butyl ester hydrochloride27532-96-3
Methyl 5-aminopentanoate hydrochloride29840-56-0
Methyl DL-valinate hydrochloride5619-05-6
Methyl L-valinate hydrochloride6306-52-1
4-Aminobutyric acid ethyl ester hydrochloride6937-16-2