Home Boronic acids 3-Methoxy-5-(trifluoromethoxy)phenylboronic acid

3-Methoxy-5-(trifluoromethoxy)phenylboronic acid

CAS No.:
1256345-88-6
Catalog Number:
AG000O0R
Molecular Formula:
C8H8BF3O4
Molecular Weight:
235.9529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$119
- +
1g
96%
In Stock USA
United States
$225
- +
5g
96%
In Stock USA
United States
$738
- +
Product Description
Catalog Number:
AG000O0R
Chemical Name:
3-Methoxy-5-(trifluoromethoxy)phenylboronic acid
CAS Number:
1256345-88-6
Molecular Formula:
C8H8BF3O4
Molecular Weight:
235.9529
MDL Number:
MFCD12026733
IUPAC Name:
[3-methoxy-5-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C8H8BF3O4/c1-15-6-2-5(9(13)14)3-7(4-6)16-8(10,11)12/h2-4,13-14H,1H3
InChI Key:
PXUPNHCVYUKZFI-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)B(O)O)OC(F)(F)F
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.047g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.953g/mol
Monoisotopic Mass:
236.047g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties