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1-bromo-3-fluoro-5-(trifluoromethyl)benzene

1-bromo-3-fluoro-5-(trifluoromethyl)benzene

CAS: 130723-13-6

Formula: C7H3BrF4

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

IUPAC: 1-bromo-3-fluoro-5-(trifluoromethyl)benzene

InChI: InChI=1S/C7H3BrF4/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H

Composition: C (34.60%), H (1.24%), Br (32.88%), F (31.27%)

Molar Mass: 242.999

Atom Count: 15

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 241.935426
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey LIGBGEJPUQBLTG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.87
Topological Polar Surface Area 0
Polarizability 14.65
Ring Count 1
Rotatable Bond Count 1

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