Home Boronic acids 4-Bromo-3-(trifluoromethyl)phenylboronic acid

4-Bromo-3-(trifluoromethyl)phenylboronic acid

CAS No.:
1310383-25-5
Catalog Number:
AG000VD0
Molecular Formula:
C7H5BBrF3O2
Molecular Weight:
268.8236
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$163
- +
5g
97%
In Stock USA
United States
$619
- +
Product Description
Catalog Number:
AG000VD0
Chemical Name:
4-Bromo-3-(trifluoromethyl)phenylboronic acid
CAS Number:
1310383-25-5
Molecular Formula:
C7H5BBrF3O2
Molecular Weight:
268.8236
MDL Number:
MFCD13181652
IUPAC Name:
[4-bromo-3-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H5BBrF3O2/c9-6-2-1-4(8(13)14)3-5(6)7(10,11)12/h1-3,13-14H
InChI Key:
CXINPDKNNNIGAH-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)C(F)(F)F)Br)O
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.952g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.824g/mol
Monoisotopic Mass:
267.952g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties