Nitrodan
[CAS# 962-02-7]

Identification

• Name: Nitrodan
• Synonyms: 3-Methyl-5-(4-Nitrophenyl)Diazenyl-2-Sulfanylidene-1,3-Thiazolidin-4-One; 5-[4-(Hydroxy-Oxidoamino)Phenyl]Diazenyl-3-Methyl-2-Sulfanylidene-1,3-Thiazolidin-4-One; N-Hydroxy-4-(3-Methyl-4-Oxo-2-Thioxo-Thiazolidin-5-Yl)Azo-Benzeneamine Oxide
• Molecular Formula: C₁₀H₈N₄O₃S₂
• Molecular Weight: 296.32
• CAS Registry Number: 962-02-7
• SMILES: C2=C(N=NC1C(N(C)C(S1)=S)=O)C=CC(=C2)[N+](=O)[O-]
• InChI: 1S/C10H8N4O3S2/c1-13-9(15)8(19-10(13)18)12-11-6-2-4-7(5-3-6)14(16)17/h2-5,8H,1H3
• InChIKey: HHLAJTWCKSBJFA-UHFFFAOYSA-N

Properties

• Density: 1.63g/cm³ (Cal.)
• Boiling point: 457.464°C at 760 mmHg (Cal.)
• Flash point: 230.466°C (Cal.)