Home Boronic acids 5-Trifluoromethyl-1,3-phenylenediboronic acid

5-Trifluoromethyl-1,3-phenylenediboronic acid

CAS No.:
913835-35-5
Catalog Number:
AG006NKP
Molecular Formula:
C7H7B2F3O4
Molecular Weight:
233.7453
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$69
- +
1g
98%
In Stock USA
United States
$132
- +
5g
98%
In Stock USA
United States
$588
- +
Product Description
Catalog Number:
AG006NKP
Chemical Name:
5-Trifluoromethyl-1,3-phenylenediboronic acid
CAS Number:
913835-35-5
Molecular Formula:
C7H7B2F3O4
Molecular Weight:
233.7453
MDL Number:
MFCD08689490
IUPAC Name:
[3-borono-5-(trifluoromethyl)phenyl]boronic acid
InChI:
InChI=1S/C7H7B2F3O4/c10-7(11,12)4-1-5(8(13)14)3-6(2-4)9(15)16/h1-3,13-16H
InChI Key:
LLTMRPLEYJEOIJ-UHFFFAOYSA-N
SMILES:
OB(c1cc(cc(c1)C(F)(F)F)B(O)O)O
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.048g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
233.744g/mol
Monoisotopic Mass:
234.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties