Home Halogens 2-bromo-6-(trifluoromethoxy)benzoic acid

2-bromo-6-(trifluoromethoxy)benzoic acid

CAS No.:
403646-46-8
Catalog Number:
AG0038QM
Molecular Formula:
C8H4BrF3O3
Molecular Weight:
285.0148
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG0038QM
Chemical Name:
2-bromo-6-(trifluoromethoxy)benzoic acid
CAS Number:
403646-46-8
Molecular Formula:
C8H4BrF3O3
Molecular Weight:
285.0148
MDL Number:
MFCD09266205
IUPAC Name:
2-bromo-6-(trifluoromethoxy)benzoic acid
InChI:
InChI=1S/C8H4BrF3O3/c9-4-2-1-3-5(6(4)7(13)14)15-8(10,11)12/h1-3H,(H,13,14)
InChI Key:
ZCMUHYSGAOIGEG-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(cccc1Br)OC(F)(F)F
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.93g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.016g/mol
Monoisotopic Mass:
283.93g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties