2-(1,1-difluoroethyl)-1,3,4-trifluorobenzene

2-(1,1-difluoroethyl)-1,3,4-trifluorobenzene

CAS: 1138445-26-7

Formula: C8H5F5

SMILES: CC(F)(F)C1=C(F)C=CC(F)=C1F

IUPAC: 2-(1,1-difluoroethyl)-1,3,4-trifluorobenzene

InChI: InChI=1S/C8H5F5/c1-8(12,13)6-4(9)2-3-5(10)7(6)11/h2-3H,1H3

Composition: C (48.99%), H (2.57%), F (48.44%)

Molar Mass: 196.12

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.031140976
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	UPYWZWWKWDATNZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.81
Topological Polar Surface Area	0
Polarizability	13.09
Ring Count	1
Rotatable Bond Count	1

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