5-(cyanomethyl)-2-fluorobenzonitrile

5-(cyanomethyl)-2-fluorobenzonitrile

CAS: 519059-09-7

Formula: C9H5FN2

SMILES: FC1=CC=C(CC#N)C=C1C#N

IUPAC: 5-(cyanomethyl)-2-fluorobenzonitrile

InChI: InChI=1S/C9H5FN2/c10-9-2-1-7(3-4-11)5-8(9)6-12/h1-2,5H,3H2

Composition: C (67.50%), H (3.15%), F (11.86%), N (17.49%)

Molar Mass: 160.151

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	160.043676332
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KRNCZBBJZSYHMX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.28
Topological Polar Surface Area	47.58
Polarizability	15.37
Ring Count	1
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	519059-09-7		$16.39-$1,208.04$16.39$27.74$92.05$403.52$1,208.04