Text Search
Structure Search

6-bromo-2-fluoro-3-(trifluoromethoxy)benzoic acid

6-bromo-2-fluoro-3-(trifluoromethoxy)benzoic acid

CAS: 524674-71-3

Formula: C8H3BrF4O3

SMILES: OC(=O)C1=C(Br)C=CC(OC(F)(F)F)=C1F

IUPAC: 6-bromo-2-fluoro-3-(trifluoromethoxy)benzoic acid

InChI: InChI=1S/C8H3BrF4O3/c9-3-1-2-4(16-8(11,12)13)6(10)5(3)7(14)15/h1-2H,(H,14,15)

Composition: C (31.71%), H (1.00%), Br (26.37%), F (25.08%), O (15.84%)

Molar Mass: 303.007

Atom Count: 19

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 301.92017
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey PMHZGWJIYADKFG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.22
Topological Polar Surface Area 46.53
Polarizability 18.07
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <10 Days 524674-71-3 Quote Only
Request Quote
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 524674-71-3 $209.33-$752.82$209.33$752.82
Request Quote