2-(trifluoromethyl)pyridine-4-carbonitrile

2-(trifluoromethyl)pyridine-4-carbonitrile

CAS: 916210-02-1

Formula: C7H3F3N2

SMILES: FC(F)(F)C1=NC=CC(=C1)C#N

IUPAC: 2-(trifluoromethyl)pyridine-4-carbonitrile

InChI: InChI=1S/C7H3F3N2/c8-7(9,10)6-3-5(4-11)1-2-12-6/h1-3H

Composition: C (48.85%), H (1.76%), F (33.12%), N (16.28%)

Molar Mass: 172.11

Atom Count: 15

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	172.024832594
Formal Charge	0
FSP3	0.14
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MLFFNKLBERSEPF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.22
Topological Polar Surface Area	36.68
Polarizability	12.59
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	916210-02-1		$51.35-$86.31$51.35$63.37$86.31