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2-fluoro-1,4-bis(trifluoromethyl)benzene

2-fluoro-1,4-bis(trifluoromethyl)benzene

CAS: 887268-08-8

Formula: C8H3F7

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

IUPAC: 2-fluoro-1,4-bis(trifluoromethyl)benzene

InChI: InChI=1S/C8H3F7/c9-6-3-4(7(10,11)12)1-2-5(6)8(13,14)15/h1-3H

Composition: C (41.40%), H (1.30%), F (57.30%)

Molar Mass: 232.101

Atom Count: 18

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 232.012297238
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey KAGRJEBZBWYSJK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.22
Topological Polar Surface Area 0
Polarizability 13.22
Ring Count 1
Rotatable Bond Count 2

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