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Chemical structure of 2-Phenylglycine

GC60485

2-Phenylglycine

Also known as 2-amino-2-phenylacetic acid

2-Phenylglycine (DL-α-Phenylglycine) is a metabolite in breast milk during the W2 to W4 lactation period

ChemicalCAS2835-06-5MW151.16FormulaC8H9NO2
CAS number
2835-06-5
Molecular weight
151.16
Formula
C8H9NO2
Solubility
H2O ： 3·33 mg/mL (22·03 mM; ultrasonic and adjust pH to 12 with NaOH); DMSO ： < 1 mg/mL (insoluble or slightly soluble)
InChIKey
ZGUNAGUHMKGQNY-UHFFFAOYSA-N
Catalogue number
GC60485
Brand
GLPBIO
Computed properties PubChem CID 3866 · XLogP -1.7 · TPSA 63.3 Ų · H-bond donors 2
XLogP
-1.7
TPSA
63.3 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
11

SMILES C1=CC=C(C=C1)C(C(=O)O)N

Computed descriptors from PubChem (CID 3866), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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