2,6-difluorobenzonitrile

2,6-difluorobenzonitrile

CAS: 1897-52-5

Formula: C7H3F2N

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

IUPAC: 2,6-difluorobenzonitrile

InChI: InChI=1S/C7H3F2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H

Composition: C (60.44%), H (2.17%), F (27.32%), N (10.07%)

Molar Mass: 139.105

Atom Count: 13

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	139.023355427
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	BNBRIFIJRKJGEI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	32.21
Topological Polar Surface Area	23.79
Polarizability	11.61
Ring Count	1
Rotatable Bond Count	0

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