Home Boronic acids 2-(Dimethylaminomethyl)-5-nitrophenylboronic acid, pinacol ester

2-(Dimethylaminomethyl)-5-nitrophenylboronic acid, pinacol ester

CAS No.:
2096335-98-5
Catalog Number:
AG01EHR1
Molecular Formula:
C15H23BN2O4
Molecular Weight:
306.1651
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$300
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG01EHR1
Chemical Name:
2-(Dimethylaminomethyl)-5-nitrophenylboronic acid, pinacol ester
CAS Number:
2096335-98-5
Molecular Formula:
C15H23BN2O4
Molecular Weight:
306.1651
MDL Number:
MFCD22205817
IUPAC Name:
N,N-dimethyl-1-[4-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine
InChI:
InChI=1S/C15H23BN2O4/c1-14(2)15(3,4)22-16(21-14)13-9-12(18(19)20)8-7-11(13)10-17(5)6/h7-9H,10H2,1-6H3
InChI Key:
LIQMHHYFJSBDFS-UHFFFAOYSA-N
SMILES:
CN(Cc1ccc(cc1B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-])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:
0
Isotope Atom Count:
0
Molecular Weight:
306.169g/mol
Monoisotopic Mass:
306.175g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties