1-chloro-3-(trifluoromethyl)benzene

1-chloro-3-(trifluoromethyl)benzene

CAS: 98-15-7

Formula: C7H4ClF3

SMILES: FC(F)(F)C1=CC=CC(Cl)=C1

IUPAC: 1-chloro-3-(trifluoromethyl)benzene

InChI: InChI=1S/C7H4ClF3/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H

Composition: C (46.57%), H (2.23%), Cl (19.63%), F (31.57%)

Molar Mass: 180.55

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	179.9953623
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	YTCGOUNVIAWCMG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	36.84
Topological Polar Surface Area	0
Polarizability	13.48
Ring Count	1
Rotatable Bond Count	1

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