cyanomethyl (2S)-2-benzamido-3-phenylpropanoate

CAS: 64187-45-7

Molecular Formula	`C18H16N2O3`
Molecular Weight	308.3 g/mol
LogP	2.9
Topological Polar Surface Area	79.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	308.1161
Heavy Atoms	23
Complexity	442.0

Chemical Identifiers

CAS Number	64187-45-7
SMILES	`C1=CC=C(C=C1)CC(C(=O)OCC#N)NC(=O)C2=CC=CC=C2`
InChIKey	`JIQFQYPZHNSZDA-INIZCTEOSA-N`

📖 Product Overview

cyanomethyl (2S)-2-benzamido-3-phenylpropanoate (CAS: 64187-45-7) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.3 g/mol. Its IUPAC systematic name is cyanomethyl (2S)-2-benzamido-3-phenylpropanoate. LogP 2.9 Topological Polar Surface Area 79.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 308.1161 Heavy Atoms 23 Complexity 442.0 InChI Key: JIQFQYPZHNSZDA-INIZCTEOSA-N. SMILES: C1=CC=C(C=C1)CC(C(=O)OCC#N)NC(=O)C2=CC=CC=C2.

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