Home Boronic acids 3-Ethoxy-5-trifluoromethylphenylboronic acid

3-Ethoxy-5-trifluoromethylphenylboronic acid

CAS No.:
871332-96-6
Catalog Number:
AG004TVB
Molecular Formula:
C9H10BF3O3
Molecular Weight:
233.9801
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$112
- +
5g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG004TVB
Chemical Name:
3-Ethoxy-5-trifluoromethylphenylboronic acid
CAS Number:
871332-96-6
Molecular Formula:
C9H10BF3O3
Molecular Weight:
233.9801
MDL Number:
MFCD08056361
IUPAC Name:
[3-ethoxy-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C9H10BF3O3/c1-2-16-8-4-6(9(11,12)13)3-7(5-8)10(14)15/h3-5,14-15H,2H2,1H3
InChI Key:
ATZRXKHRSOTBAM-UHFFFAOYSA-N
SMILES:
CCOc1cc(cc(c1)C(F)(F)F)B(O)O
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.068g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.981g/mol
Monoisotopic Mass:
234.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties