AC1NPJL3 structure

AC1NPJL3

3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide

Also Known As: 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide|3-Nitro-4-{2-[1-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)propan-2-ylidene]hydrazin-1-yl}benzene-1-sulfonamide

CAS: 5384-20-3
Molecular Formula C16H15N5O7S2
Molecular Weight 453.0413 g/mol
LogP 0.8747
Topological Polar Surface Area 182.14 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 9
Rotatable Bonds 6
Exact Mass 453.0413
Monoisotopic Mass 453.0413
Heavy Atoms 30
Complexity 1303.014

Chemical Identifiers

CAS Number 5384-20-3
SMILES CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-])CN2C(=O)C3=CC=CC=C3S2(=O)=O

Product Overview

AC1NPJL3 (CAS 5384-20-3), with molecular formula C16H15N5O7S2 and molecular weight 453.0413 g/mol. IUPAC: 3-nitro-4-[2-[1-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propan-2-ylidene]hydrazinyl]benzenesulfonamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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