7-Nitro-N-[2-(2-pyridinyldithio)ethyl]-2,1,3-Benzoxadiazol-4-amine
[CAS# 58210-58-5]

Identification

• Name: 7-Nitro-N-[2-(2-pyridinyldithio)ethyl]-2,1,3-Benzoxadiazol-4-amine
• Synonyms: 4-Nitro-N-[2-(2-Pyridyldisulfanyl)Ethyl]-2,1,3-Benzoxadiazol-7-Amine; (7-Nitrobenzofurazan-4-Yl)-[2-(2-Pyridyldisulfanyl)Ethyl]Amine; 1,4-(N-2-Aminoethyl-2'-Pyridyl Disulfide)-7-Nitrobenzo-2-Oxa-1,3-Diazole
• Molecular Formula: C₁₃H₁₁N₅O₃S₂
• Molecular Weight: 349.38
• CAS Registry Number: 58210-58-5
• SMILES: C2=C([N+]([O-])=O)C1=NON=C1C(=C2)NCCSSC3=NC=CC=C3
• InChI: 1S/C13H11N5O3S2/c19-18(20)10-5-4-9(12-13(10)17-21-16-12)14-7-8-22-23-11-3-1-2-6-15-11/h1-6,14H,7-8H2
• InChIKey: HYSMRQGFWZUAOC-UHFFFAOYSA-N

Properties

• Density: 1.555g/cm³ (Cal.)
• Boiling point: 583.586°C at 760 mmHg (Cal.)
• Flash point: 306.742°C (Cal.)