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Chemical structure of N-(4-Cyanophenyl)glycine

GC66237

N-(4-Cyanophenyl)glycine

Also known as 2-(4-cyanoanilino)acetic acid

N-(4-Cyanophenyl)glycine is a Glycine (HY-Y0966) derivative

ChemicalCAS42288-26-6MW176.17FormulaC9H8N2O2
CAS number
42288-26-6
Molecular weight
176.17
Formula
C9H8N2O2
Solubility
DMSO ： 100 mg/mL (567·63 mM; Need ultrasonic)
InChIKey
KJRQMXRCZULRHF-UHFFFAOYSA-N
Catalogue number
GC66237
Brand
GLPBIO
Computed properties PubChem CID 817965 · XLogP 0.3 · TPSA 73.1 Ų · H-bond donors 2
XLogP
0.3
TPSA
73.1 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
13

SMILES C1=CC(=CC=C1C#N)NCC(=O)O

Computed descriptors from PubChem (CID 817965), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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