Home Boronic acids 3-Fluoro-4-trifluoromethylphenylboronic acid

3-Fluoro-4-trifluoromethylphenylboronic acid

CAS No.:
864759-68-2
Catalog Number:
AG008G2G
Molecular Formula:
C7H5BF4O2
Molecular Weight:
207.9180
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$94
- +
5g
95%
In Stock USA
United States
$216
- +
25g
98%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG008G2G
Chemical Name:
3-Fluoro-4-trifluoromethylphenylboronic acid
CAS Number:
864759-68-2
Molecular Formula:
C7H5BF4O2
Molecular Weight:
207.9180
MDL Number:
MFCD08706261
IUPAC Name:
[3-fluoro-4-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H5BF4O2/c9-6-3-4(8(13)14)1-2-5(6)7(10,11)12/h1-3,13-14H
InChI Key:
OPDBJTGUPJBGII-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)F)C(F)(F)F)O
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.032g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
207.919g/mol
Monoisotopic Mass:
208.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties