5-(Phenylmethyl) hydrogen D-glutamate

C12H15NO4CAS 2578-33-8237.26 g/mol

H2NOOOHO
Carboxylic acidEsterPrimary amine

Properties

Molecular formula
C12H15NO4
Molar mass
237.26 g/mol
Exact mass
237.1001 Da
Melting point
147–148 °C
logP
0.92Crippen estimate
Polar surface area
89.6 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
6
Stereocentres
Rin 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
2578-33-8
SMILES
N[C@H](CCC(=O)OCc1ccccc1)C(=O)O
InChIKey
BGGHCRNCRWQABU-SNVBAGLBSA-N
InChI
InChI=1S/C12H15NO4/c13-10(12(15)16)6-7-11(14)17-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,15,16)/t10-/m1/s1

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Names and synonyms

6 names
  • D-Glutamic acid, 5-(phenylmethyl) ester
  • Glutamic acid, 5-benzyl ester, D-
  • γ-Benzyl D-glutamate
  • D-Glutamic acid γ-benzyl ester
  • D-Glutamic acid 5-benzyl ester
  • (2R)-2-Amino-5-oxo-5-phenylmethoxypentanoic acid

Work with 5-(Phenylmethyl) hydrogen D-glutamate

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

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

Same formula

Elsewhere