[3-bromo-5-(trifluoromethoxy)phenyl]methanol

[3-bromo-5-(trifluoromethoxy)phenyl]methanol

CAS: 1026201-95-5

Formula: C8H6BrF3O2

SMILES: OCC1=CC(OC(F)(F)F)=CC(Br)=C1

IUPAC: [3-bromo-5-(trifluoromethoxy)phenyl]methanol

InChI: InChI=1S/C8H6BrF3O2/c9-6-1-5(4-13)2-7(3-6)14-8(10,11)12/h1-3,13H,4H2

Composition: C (35.45%), H (2.23%), Br (29.48%), F (21.03%), O (11.81%)

Molar Mass: 271.033

Atom Count: 20

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	269.950327
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	CQQFETSXXFSLPO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.57
Topological Polar Surface Area	29.46
Polarizability	17.97
Ring Count	1
Rotatable Bond Count	3

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