Home Boronic acids 2,3,6-Trifluorophenylboronic acid

2,3,6-Trifluorophenylboronic acid

CAS No.:
247564-71-2
Catalog Number:
AG002PC7
Molecular Formula:
C6H4BF3O2
Molecular Weight:
175.9010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$32
- +
25g
98%
In Stock USA
United States
$119
- +
100g
98%
In Stock USA
United States
$388
- +
Product Description
Catalog Number:
AG002PC7
Chemical Name:
2,3,6-Trifluorophenylboronic acid
CAS Number:
247564-71-2
Molecular Formula:
C6H4BF3O2
Molecular Weight:
175.9010
MDL Number:
MFCD01863167
IUPAC Name:
(2,3,6-trifluorophenyl)boronic acid
InChI:
InChI=1S/C6H4BF3O2/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,11-12H
InChI Key:
IWPDDRPLEKURGG-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1F)B(O)O)F
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.026g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
175.901g/mol
Monoisotopic Mass:
176.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
A convenient catalyst system for microwave accelerated cross-coupling of a range of aryl boronic acids with aryl chlorides. Beilstein journal of organic chemistry 20070101
Properties