Home Boronic acids 4-Bromo-2-fluoro-5-(trifluoromethyl)phenylboronic acid, pinacol ester

4-Bromo-2-fluoro-5-(trifluoromethyl)phenylboronic acid, pinacol ester

CAS No.:
2096337-75-4
Catalog Number:
AG01EHOG
Molecular Formula:
C13H14BBrF4O2
Molecular Weight:
368.9577
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$150
- +
1g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG01EHOG
Chemical Name:
4-Bromo-2-fluoro-5-(trifluoromethyl)phenylboronic acid, pinacol ester
CAS Number:
2096337-75-4
Molecular Formula:
C13H14BBrF4O2
Molecular Weight:
368.9577
MDL Number:
MFCD20441906
IUPAC Name:
2-[4-bromo-2-fluoro-5-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H14BBrF4O2/c1-11(2)12(3,4)21-14(20-11)8-5-7(13(17,18)19)9(15)6-10(8)16/h5-6H,1-4H3
InChI Key:
OMJWHTOKPXUEAI-UHFFFAOYSA-N
SMILES:
FC(c1cc(B2OC(C(O2)(C)C)(C)C)c(cc1Br)F)(F)F
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.021g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.961g/mol
Monoisotopic Mass:
368.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties