Home Boronic acids 2-fluoro-5-methyl-3-(trifluoromethyl)phenylboronic acid

2-fluoro-5-methyl-3-(trifluoromethyl)phenylboronic acid

CAS No.:
2096341-51-2
Catalog Number:
AG01EHKM
Molecular Formula:
C8H7BF4O2
Molecular Weight:
221.9446
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$350
- +
1g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG01EHKM
Chemical Name:
2-fluoro-5-methyl-3-(trifluoromethyl)phenylboronic acid
CAS Number:
2096341-51-2
Molecular Formula:
C8H7BF4O2
Molecular Weight:
221.9446
MDL Number:
MFCD20441820
IUPAC Name:
[2-fluoro-5-methyl-3-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C8H7BF4O2/c1-4-2-5(8(11,12)13)7(10)6(3-4)9(14)15/h2-3,14-15H,1H3
InChI Key:
NBBCDCFKLBCLSG-UHFFFAOYSA-N
SMILES:
Cc1cc(B(O)O)c(c(c1)C(F)(F)F)F
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.048g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.946g/mol
Monoisotopic Mass:
222.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties