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Home > Nitro Compounds > 19044-93-0
19044-93-0 | Benzenesulfonamide, N-methyl-3,5-dinitro-4-(1-piperidinyl)-
CAS No: 19044-93-0 Catalog No: AG002EKE MDL No:
Product Description
Catalog Number:
AG002EKE
Chemical Name:
Benzenesulfonamide, N-methyl-3,5-dinitro-4-(1-piperidinyl)-
CAS Number:
19044-93-0
Molecular Formula:
C12H16N4O6S
Molecular Weight:
344.3436
IUPAC Name:
N-methyl-3,5-dinitro-4-piperidin-1-ylbenzenesulfonamide
InChI:
InChI=1S/C12H16N4O6S/c1-13-23(21,22)9-7-10(15(17)18)12(11(8-9)16(19)20)14-5-3-2-4-6-14/h7-8,13H,2-6H2,1H3
InChI Key:
AOPLASFAHDNPCE-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])N1CCCCC1
NSC Number:
310265
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.079g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.342g/mol
Monoisotopic Mass:
344.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
149A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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