Home Boronic acids 3-Formyl-5-(trifluoromethyl)phenylboronic acid

3-Formyl-5-(trifluoromethyl)phenylboronic acid

CAS No.:
1451393-24-0
Catalog Number:
AG00AR4S
Molecular Formula:
C8H6BF3O3
Molecular Weight:
217.9376
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$200
- +
5g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00AR4S
Chemical Name:
3-Formyl-5-(trifluoromethyl)phenylboronic acid
CAS Number:
1451393-24-0
Molecular Formula:
C8H6BF3O3
Molecular Weight:
217.9376
MDL Number:
MFCD16295235
IUPAC Name:
[3-formyl-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C8H6BF3O3/c10-8(11,12)6-1-5(4-13)2-7(3-6)9(14)15/h1-4,14-15H
InChI Key:
PUGXLUVQWNOCAW-UHFFFAOYSA-N
SMILES:
O=Cc1cc(cc(c1)C(F)(F)F)B(O)O
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.938g/mol
Monoisotopic Mass:
218.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties