Home Boronic acids 2-Methyl-5-nitrophenylboronic acid, pinacol ester

2-Methyl-5-nitrophenylboronic acid, pinacol ester

CAS No.:
957062-84-9
Catalog Number:
AG003HNS
Molecular Formula:
C13H18BNO4
Molecular Weight:
263.0973
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97%
In Stock USA
United States
$61
- +
5g
>97%
In Stock USA
United States
$165
- +
Product Description
Catalog Number:
AG003HNS
Chemical Name:
2-Methyl-5-nitrophenylboronic acid, pinacol ester
CAS Number:
957062-84-9
Molecular Formula:
C13H18BNO4
Molecular Weight:
263.0973
MDL Number:
MFCD09027081
IUPAC Name:
4,4,5,5-tetramethyl-2-(2-methyl-5-nitrophenyl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BNO4/c1-9-6-7-10(15(16)17)8-11(9)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3
InChI Key:
LYFUUPOOXAXEEP-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cc(ccc1C)[N+](=O)[O-]
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.133g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.1g/mol
Monoisotopic Mass:
263.133g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties