1-(4-chlorophenyl)-2-oxopyrrolidine-3-carbonitrile

1-(4-chlorophenyl)-2-oxopyrrolidine-3-carbonitrile

CAS: 930298-99-0

Formula: C11H9ClN2O

SMILES: ClC1=CC=C(C=C1)N1CCC(C#N)C1=O

IUPAC: 1-(4-chlorophenyl)-2-oxopyrrolidine-3-carbonitrile

InChI: InChI=1/C11H9ClN2O/c12-9-1-3-10(4-2-9)14-6-5-8(7-13)11(14)15/h1-4,8H,5-6H2

Composition: C (59.88%), H (4.11%), Cl (16.07%), N (12.70%), O (7.25%)

Molar Mass: 220.66

Atom Count: 24

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	220.0403406
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	OKPAZZYGDHLPBU-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.01
Topological Polar Surface Area	44.1
Polarizability	21.74
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	930298-99-0		$51.35-$539.70$51.35$63.37$86.31$113.62$180.26$539.70