2-(2,5-difluorophenyl)acetonitrile

2-(2,5-difluorophenyl)acetonitrile

CAS: 69584-87-8

Formula: C8H5F2N

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

IUPAC: 2-(2,5-difluorophenyl)acetonitrile

InChI: InChI=1S/C8H5F2N/c9-7-1-2-8(10)6(5-7)3-4-11/h1-2,5H,3H2

Composition: C (62.75%), H (3.29%), F (24.81%), N (9.15%)

Molar Mass: 153.132

Atom Count: 16

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	153.039005491
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	UIMMFRUOZOWROM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.78
Topological Polar Surface Area	23.79
Polarizability	13.28
Ring Count	1
Rotatable Bond Count	1

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