Home Other Building Blocks 4-Borono-2-(trifluoromethyl)benzoic acid

4-Borono-2-(trifluoromethyl)benzoic acid

CAS No.:
1050424-03-7
Catalog Number:
AG0090EV
Molecular Formula:
C8H6BF3O4
Molecular Weight:
233.9370
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$219
- +
5g
98%
In Stock USA
United States
$875
- +
Product Description
Catalog Number:
AG0090EV
Chemical Name:
4-Borono-2-(trifluoromethyl)benzoic acid
CAS Number:
1050424-03-7
Molecular Formula:
C8H6BF3O4
Molecular Weight:
233.9370
MDL Number:
MFCD11856032
IUPAC Name:
4-borono-2-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C8H6BF3O4/c10-8(11,12)6-3-4(9(15)16)1-2-5(6)7(13)14/h1-3,15-16H,(H,13,14)
InChI Key:
WYTZBGVJUBFOBU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)C(F)(F)F)C(=O)O)O
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.031g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
233.937g/mol
Monoisotopic Mass:
234.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties