200,000+ products from a single source!

sales@angenechem.com

Home > Amines > 19092-03-6

19092-03-6

19092-03-6 | Benzenamine, N-methyl-N,2,4-trinitro-

CAS No: 19092-03-6 Catalog No: AG002EWQ MDL No:

Product Description

Catalog Number:
AG002EWQ
Chemical Name:
Benzenamine, N-methyl-N,2,4-trinitro-
CAS Number:
19092-03-6
Molecular Formula:
C7H6N4O6
Molecular Weight:
242.1457
IUPAC Name:
N-(2,4-dinitrophenyl)-N-methylnitramide
InChI:
InChI=1S/C7H6N4O6/c1-8(11(16)17)6-3-2-5(9(12)13)4-7(6)10(14)15/h2-4H,1H3
InChI Key:
BUGRLMJGTJHURD-UHFFFAOYSA-N
SMILES:
CN(c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Properties

Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.029g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.147g/mol
Monoisotopic Mass:
242.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Literature

Title Journal
Interactions of nitroaromatic compounds with the mammalian selenoprotein thioredoxin reductase and the relation to induction of apoptosis in human cancer cells. The Journal of biological chemistry 20060303
Molecular rearrangement. 36. Selective alpha-CH oxidation of alkylarenes by nitrogen dioxide on thermolysis with nitramines. The Journal of organic chemistry 20041001

Related Products

© 2019 Angene International Limited. All rights Reserved.