Home Boronic acids 3-(Tetrahydro-2H-pyran-4-ylmethoxy)-5-trifluoromethylphenylboronic acid, pinacol ester

3-(Tetrahydro-2H-pyran-4-ylmethoxy)-5-trifluoromethylphenylboronic acid, pinacol ester

CAS No.:
2096330-34-4
Catalog Number:
AG01EH9I
Molecular Formula:
C19H26BF3O4
Molecular Weight:
386.2135
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$188
- +
1g
96%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG01EH9I
Chemical Name:
3-(Tetrahydro-2H-pyran-4-ylmethoxy)-5-trifluoromethylphenylboronic acid, pinacol ester
CAS Number:
2096330-34-4
Molecular Formula:
C19H26BF3O4
Molecular Weight:
386.2135
MDL Number:
MFCD18087744
IUPAC Name:
4,4,5,5-tetramethyl-2-[3-(oxan-4-ylmethoxy)-5-(trifluoromethyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C19H26BF3O4/c1-17(2)18(3,4)27-20(26-17)15-9-14(19(21,22)23)10-16(11-15)25-12-13-5-7-24-8-6-13/h9-11,13H,5-8,12H2,1-4H3
InChI Key:
WMDAQVFYXLSPMS-UHFFFAOYSA-N
SMILES:
FC(c1cc(OCC2CCOCC2)cc(c1)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Complexity:
490  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.188g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.218g/mol
Monoisotopic Mass:
386.188g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties