Phenylalanine ethyl ester hydrochloride

C11H16ClNO2CAS 3182-93-2229.70 g/mol

OOH2NHCl
EsterPrimary amine

Properties

Molecular formula
C11H16ClNO2
Molar mass
229.70 g/mol
Exact mass
229.0870 Da
Melting point
126–127 °C
logP
1.54Crippen estimate
Polar surface area
52.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
3182-93-2
SMILES
CCOC(=O)[C@@H](N)Cc1ccccc1.Cl
InChIKey
FPFQPLFYTKMCHN-PPHPATTJSA-N
InChI
InChI=1S/C11H15NO2.ClH/c1-2-14-11(13)10(12)8-9-6-4-3-5-7-9;/h3-7,10H,2,8,12H2,1H3;1H/t10-;/m0./s1

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Names and synonyms

7 names
  • L-Phenylalanine, ethyl ester, hydrochloride (1:1)
  • Alanine, phenyl-, ethyl ester, hydrochloride, L-(-)-
  • L-Phenylalanine, ethyl ester, hydrochloride
  • (S)-Phenylalanine ethyl ester hydrochloride
  • Ethyl L-phenylalaninate hydrochloride
  • L-Phenylalanine ether ester hydrochloride
  • L-Ethyl phenylalanine hydrochloride

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

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