Home Boronic acids 3-(Tetrahydropyran-4-yloxy)-5-trifluoromethylphenylboronic acid, pinacol ester

3-(Tetrahydropyran-4-yloxy)-5-trifluoromethylphenylboronic acid, pinacol ester

CAS No.:
2096341-24-9
Catalog Number:
AG01EH9F
Molecular Formula:
C18H24BF3O4
Molecular Weight:
372.1870
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:
AG01EH9F
Chemical Name:
3-(Tetrahydropyran-4-yloxy)-5-trifluoromethylphenylboronic acid, pinacol ester
CAS Number:
2096341-24-9
Molecular Formula:
C18H24BF3O4
Molecular Weight:
372.1870
MDL Number:
MFCD18434454
IUPAC Name:
4,4,5,5-tetramethyl-2-[3-(oxan-4-yloxy)-5-(trifluoromethyl)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C18H24BF3O4/c1-16(2)17(3,4)26-19(25-16)13-9-12(18(20,21)22)10-15(11-13)24-14-5-7-23-8-6-14/h9-11,14H,5-8H2,1-4H3
InChI Key:
SJAHTTWVNOBUEO-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(OC2CCOCC2)cc(c1)C(F)(F)F
Properties
Complexity:
475  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.172g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
372.191g/mol
Monoisotopic Mass:
372.172g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties