1-iodo-3,5-bis(trifluoromethyl)benzene

1-iodo-3,5-bis(trifluoromethyl)benzene

CAS: 328-73-4

Formula: C8H3F6I

SMILES: FC(F)(F)C1=CC(=CC(I)=C1)C(F)(F)F

IUPAC: 1-iodo-3,5-bis(trifluoromethyl)benzene

InChI: InChI=1S/C8H3F6I/c9-7(10,11)4-1-5(8(12,13)14)3-6(15)2-4/h1-3H

Composition: C (28.26%), H (0.89%), F (33.53%), I (37.32%)

Molar Mass: 340.007

Atom Count: 18

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	339.91836
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	VDPIZIZDKPFXLI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.37
Topological Polar Surface Area	0
Polarizability	18.86
Ring Count	1
Rotatable Bond Count	2

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