chempirical

(S)-2-Amino-4-phenylbutanoic acid hydrochloride

C10H14ClNO2CAS 105382-09-0215.68 g/mol

Open in Covalent MOL file
OOHNH2HCl

Properties

Molecular formula
C10H14ClNO2
Molar mass
215.68 g/mol
Exact mass
215.0713 Da
logP
1.45Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
4

Identifiers

CAS number
105382-09-0
SMILES
C1=CC=C(C=C1)CC[C@@H](C(=O)O)N.Cl
InChIKey
CHBMONIBOQCTCF-FVGYRXGTSA-N
InChI
InChI=1S/C10H13NO2.ClH/c11-9(10(12)13)7-6-8-4-2-1-3-5-8;/h1-5,9H,6-7,11H2,(H,12,13);1H/t9-;/m0./s1

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Names and synonyms

1 names
  • L-Homophenylalanine hydrochloride

Work with (S)-2-Amino-4-phenylbutanoic acid 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 (R)-phenylalaninate hydrochloride13033-84-6 (S)-3-Amino-4-phenylbutyric acid hydrochloride138165-77-2 Ethyl D-phenylglycinate hydrochloride17609-48-2 Alanine benzyl ester hydrochloride5557-83-5 (±)-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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