4,4-difluorocyclohexane-1-carbonitrile

4,4-difluorocyclohexane-1-carbonitrile

CAS: 922728-21-0

Formula: C7H9F2N

SMILES: FC1(F)CCC(CC1)C#N

IUPAC: 4,4-difluorocyclohexane-1-carbonitrile

InChI: InChI=1S/C7H9F2N/c8-7(9)3-1-6(5-10)2-4-7/h6H,1-4H2

Composition: C (57.92%), H (6.25%), F (26.18%), N (9.65%)

Molar Mass: 145.153

Atom Count: 19

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	145.07030562
Formal Charge	0
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	IZGJQRIMRGAMTH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.42
Topological Polar Surface Area	23.79
Polarizability	12.31
Ring Count	1
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	922728-21-0		$179.52-$2,042.04$179.52$413.27$647.02$2,042.04

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95%	<5 Days	922728-21-0		$18.92-$2,722.50$18.92$31.53$79.44$283.73$472.88$982.32$1,650.65$2,722.50