Home Boronic acids 2-Hydroxy-3-(trifluoromethyl)phenylboronic acid, pinacol ester

2-Hydroxy-3-(trifluoromethyl)phenylboronic acid, pinacol ester

CAS No.:
2055742-98-6
Catalog Number:
AG01C40X
Molecular Formula:
C13H16BF3O3
Molecular Weight:
288.0705
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG01C40X
Chemical Name:
2-Hydroxy-3-(trifluoromethyl)phenylboronic acid, pinacol ester
CAS Number:
2055742-98-6
Molecular Formula:
C13H16BF3O3
Molecular Weight:
288.0705
MDL Number:
MFCD16994256
IUPAC Name:
2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)phenol
InChI:
InChI=1S/C13H16BF3O3/c1-11(2)12(3,4)20-14(19-11)9-7-5-6-8(10(9)18)13(15,16)17/h5-7,18H,1-4H3
InChI Key:
BWUQMVGZBPQGOY-UHFFFAOYSA-N
SMILES:
FC(c1cccc(c1O)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.114g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
288.073g/mol
Monoisotopic Mass:
288.114g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties