Home Boronic acids 2,3-Difluoro-4-(trifluoromethyl)benzeneboronic acid

2,3-Difluoro-4-(trifluoromethyl)benzeneboronic acid

CAS No.:
2096332-61-3
Catalog Number:
AG01EHAX
Molecular Formula:
C7H4BF5O2
Molecular Weight:
225.9085
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$625
- +
Product Description
Catalog Number:
AG01EHAX
Chemical Name:
2,3-Difluoro-4-(trifluoromethyl)benzeneboronic acid
CAS Number:
2096332-61-3
Molecular Formula:
C7H4BF5O2
Molecular Weight:
225.9085
MDL Number:
MFCD14892600
IUPAC Name:
[2,3-difluoro-4-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H4BF5O2/c9-5-3(7(11,12)13)1-2-4(6(5)10)8(14)15/h1-2,14-15H
InChI Key:
KFZQEXGUUYWITP-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1F)F)C(F)(F)F)O
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.022g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
225.909g/mol
Monoisotopic Mass:
226.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties