Alanine benzyl ester hydrochloride

C₁₀H₁₄ClNO₂CAS 5557-83-5215.68 g/mol

Open in Covalent MOL file

Ester Halogen Primary Amine

Properties

Molecular formula: C₁₀H₁₄ClNO₂
Molar mass: 215.68 g/mol
Exact mass: 215.0713 Da
Melting point: 140 °C
logP: 1.50Crippen estimate
Polar surface area: 52.3 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3

Identifiers

CAS number

5557-83-5

SMILES

C[C@H](N)C(=O)OCc1ccccc1.Cl

InChIKey

RLMHWGDKMJIEHH-QRPNPIFTSA-N

InChI

InChI=1S/C10H13NO2.ClH/c1-8(11)10(12)13-7-9-5-3-2-4-6-9;/h2-6,8H,7,11H2,1H3;1H/t8-;/m0./s1

Weigh it out

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

Names and synonyms

10 names

L-Alanine, phenylmethyl ester, hydrochloride (1:1)
Benzyl L-alaninate hydrochloride
Alanine, benzyl ester, hydrochloride, L-
L-Alanine, phenylmethyl ester, hydrochloride
L-Alanine benzyl ester hydrochloride
NSC 523831
(S)-Alanine hydrochloride benzyl ester
(S)-Benzyl 2-aminopropanoate hydrochloride
Benzyl alaninate hydrochloride
L-Alanine benzyl ester hydrogen chloride

Work with Alanine benzyl 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

(S)-2-Amino-4-phenylbutanoic acid hydrochloride105382-09-0 Methyl (R)-phenylalaninate hydrochloride13033-84-6 (S)-3-Amino-4-phenylbutyric acid hydrochloride138165-77-2 Ethyl D-phenylglycinate hydrochloride17609-48-2 (±)-Phenylalanine methyl ester hydrochloride5619-07-8 Methyl L-phenylalaninate hydrochloride7524-50-7 2,2′-[(3-Chlorophenyl)imino]bis[ethanol]92-00-2

Elsewhere

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