2-(2-benzoylphenyl)-2-phenylacetonitrile

2-(2-benzoylphenyl)-2-phenylacetonitrile

CAS: 127667-32-7

Formula: C21H15NO

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

IUPAC: 2-(2-benzoylphenyl)-2-phenylacetonitrile

InChI: InChI=1/C21H15NO/c22-15-20(16-9-3-1-4-10-16)18-13-7-8-14-19(18)21(23)17-11-5-2-6-12-17/h1-14,20H

Composition: C (84.82%), H (5.08%), N (4.71%), O (5.38%)

Molar Mass: 297.357

Atom Count: 38

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	297.115364107
Formal Charge	0
FSP3	0.05
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	BBWCPPJXHVYXFX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.59
Topological Polar Surface Area	40.86
Polarizability	35.15
Ring Count	3
Rotatable Bond Count	4

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95%	<2 Days	127667-32-7		$51.35-$113.62$51.35$63.37$86.31$113.62