Home Boronic acids 3-Bromo-5-(trifluoromethoxy)phenylboronic acid

3-Bromo-5-(trifluoromethoxy)phenylboronic acid

CAS No.:
1072951-48-4
Catalog Number:
AG007ES0
Molecular Formula:
C7H5BBrF3O3
Molecular Weight:
284.8230
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG007ES0
Chemical Name:
3-Bromo-5-(trifluoromethoxy)phenylboronic acid
CAS Number:
1072951-48-4
Molecular Formula:
C7H5BBrF3O3
Molecular Weight:
284.8230
MDL Number:
MFCD11504853
IUPAC Name:
[3-bromo-5-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C7H5BBrF3O3/c9-5-1-4(8(13)14)2-6(3-5)15-7(10,11)12/h1-3,13-14H
InChI Key:
MRIQPQPZRLURMR-UHFFFAOYSA-N
SMILES:
Brc1cc(cc(c1)B(O)O)OC(F)(F)F
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