2-fluoro-4-(trifluoromethyl)benzonitrile

2-fluoro-4-(trifluoromethyl)benzonitrile

CAS: 146070-34-0

Formula: C8H3F4N

SMILES: FC1=C(C=CC(=C1)C(F)(F)F)C#N

IUPAC: 2-fluoro-4-(trifluoromethyl)benzonitrile

InChI: InChI=1S/C8H3F4N/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-3H

Composition: C (50.81%), H (1.60%), F (40.18%), N (7.41%)

Molar Mass: 189.113

Atom Count: 16

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	189.020161753
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	JLTYVTXTSOYXMX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.97
Topological Polar Surface Area	23.79
Polarizability	13.27
Ring Count	1
Rotatable Bond Count	1

Suppliers

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	146070-34-0		$4.60-$174.80$4.60$6.90$14.95$26.45$50.60$174.80

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	146070-34-0		$628.00-$923.00$628.00$738.00$923.00

Chemcia Scientific, LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<2 Days	146070-34-0		$143.75$143.75