2-(2,4-dichlorophenyl)-4-oxo-4-phenylbutanenitrile

2-(2,4-dichlorophenyl)-4-oxo-4-phenylbutanenitrile

CAS: 344280-16-6

Formula: C16H11Cl2NO

SMILES: ClC1=CC(Cl)=C(C=C1)C(CC(=O)C1=CC=CC=C1)C#N

IUPAC: 2-(2,4-dichlorophenyl)-4-oxo-4-phenylbutanenitrile

InChI: InChI=1/C16H11Cl2NO/c17-13-6-7-14(15(18)9-13)12(10-19)8-16(20)11-4-2-1-3-5-11/h1-7,9,12H,8H2

Composition: C (63.18%), H (3.65%), Cl (23.31%), N (4.60%), O (5.26%)

Molar Mass: 304.17

Atom Count: 31

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	303.0217694
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RTJHDDNJNIDKAJ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.61
Topological Polar Surface Area	40.86
Polarizability	30.92
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	344280-16-6		$51.35-$524.40$51.35$63.37$86.31$524.40