1-bromo-2,5-difluoro-4-(trifluoromethoxy)benzene

1-bromo-2,5-difluoro-4-(trifluoromethoxy)benzene

CAS: 1439904-14-9

Formula: C7H2BrF5O

SMILES: FC1=CC(Br)=C(F)C=C1OC(F)(F)F

IUPAC: 1-bromo-2,5-difluoro-4-(trifluoromethoxy)benzene

InChI: InChI=1S/C7H2BrF5O/c8-3-1-5(10)6(2-4(3)9)14-7(11,12)13/h1-2H

Composition: C (30.35%), H (0.73%), Br (28.85%), F (34.29%), O (5.78%)

Molar Mass: 276.988

Atom Count: 16

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	275.920918
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	VZGIQFLXELBTGP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.18
Topological Polar Surface Area	9.23
Polarizability	15.51
Ring Count	1
Rotatable Bond Count	2

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