Home Boronic acids 4-Bromo-2-(trifluoromethoxy)phenylboronic acid

4-Bromo-2-(trifluoromethoxy)phenylboronic acid

CAS No.:
1048990-22-2
Catalog Number:
AG007XBF
Molecular Formula:
C7H5BBrF3O3
Molecular Weight:
284.8230
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$188
- +
1g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG007XBF
Chemical Name:
4-Bromo-2-(trifluoromethoxy)phenylboronic acid
CAS Number:
1048990-22-2
Molecular Formula:
C7H5BBrF3O3
Molecular Weight:
284.8230
MDL Number:
MFCD20441792
IUPAC Name:
[4-bromo-2-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C7H5BBrF3O3/c9-4-1-2-5(8(13)14)6(3-4)15-7(10,11)12/h1-3,13-14H
InChI Key:
NXVYGJHJHNUQDB-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1OC(F)(F)F)Br)O
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.947g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.823g/mol
Monoisotopic Mass:
283.947g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties