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

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

CAS: 32247-96-4

Formula: C9H5BrF6

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

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

InChI: InChI=1S/C9H5BrF6/c10-4-5-1-6(8(11,12)13)3-7(2-5)9(14,15)16/h1-3H,4H2

Composition: C (35.21%), H (1.64%), Br (26.02%), F (37.13%)

Molar Mass: 307.033

Atom Count: 21

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	305.947882
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
InChIKey	ATLQGZVLWOURFU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.86
Topological Polar Surface Area	0
Polarizability	18.1
Ring Count	1
Rotatable Bond Count	3

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