Home Boronic acids 4-Isopropylamino-3-nitrophenylboronic acid, pinacol ester

4-Isopropylamino-3-nitrophenylboronic acid, pinacol ester

CAS No.:
1218791-21-9
Catalog Number:
AG009IPW
Molecular Formula:
C15H23BN2O4
Molecular Weight:
306.1651
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$100
- +
5g
96%
In Stock USA
United States
$300
- +
10g
96%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG009IPW
Chemical Name:
4-Isopropylamino-3-nitrophenylboronic acid, pinacol ester
CAS Number:
1218791-21-9
Molecular Formula:
C15H23BN2O4
Molecular Weight:
306.1651
MDL Number:
MFCD12546468
IUPAC Name:
2-nitro-N-propan-2-yl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI:
InChI=1S/C15H23BN2O4/c1-10(2)17-12-8-7-11(9-13(12)18(19)20)16-21-14(3,4)15(5,6)22-16/h7-10,17H,1-6H3
InChI Key:
CPFXSYOPICKDOB-UHFFFAOYSA-N
SMILES:
CC(Nc1ccc(cc1[N+](=O)[O-])B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
406  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.175g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
306.169g/mol
Monoisotopic Mass:
306.175g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties