Home Boronic acids 2,6-Difluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester

2,6-Difluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester

CAS No.:
1218791-32-2
Catalog Number:
AG0016BO
Molecular Formula:
C14H17BF2O4
Molecular Weight:
298.0902
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$132
- +
1g
98%
In Stock USA
United States
$425
- +
Product Description
Catalog Number:
AG0016BO
Chemical Name:
2,6-Difluoro-4-(methoxycarbonyl)phenylboronic acid, pinacol ester
CAS Number:
1218791-32-2
Molecular Formula:
C14H17BF2O4
Molecular Weight:
298.0902
MDL Number:
MFCD12546491
IUPAC Name:
methyl 3,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C14H17BF2O4/c1-13(2)14(3,4)21-15(20-13)11-9(16)6-8(7-10(11)17)12(18)19-5/h6-7H,1-5H3
InChI Key:
CGADBVGBEFYTMK-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(c(c1)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
388  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.119g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.093g/mol
Monoisotopic Mass:
298.119g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties