4-cyano-N-(2-methylphenyl)benzamide

4-cyano-N-(2-methylphenyl)benzamide

CAS: 744213-22-7

Formula: C15H12N2O

SMILES: CC1=C(NC(=O)C2=CC=C(C=C2)C#N)C=CC=C1

IUPAC: 4-cyano-N-(2-methylphenyl)benzamide

InChI: InChI=1S/C15H12N2O/c1-11-4-2-3-5-14(11)17-15(18)13-8-6-12(10-16)7-9-13/h2-9H,1H3,(H,17,18)

Composition: C (76.25%), H (5.12%), N (11.86%), O (6.77%)

Molar Mass: 236.274

Atom Count: 30

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	236.094963014
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	OAUQYEIHNYICBR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.35
Topological Polar Surface Area	52.89
Polarizability	26.54
Ring Count	2
Rotatable Bond Count	2

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95%	<5 Days	744213-22-7		$1,700.00-$2,750.00$1,700.00$2,080.00$2,750.00