1-Octyl-1,2-dihydro-5H-tetrazole-5-thione
[CAS# 70253-99-5]

Identification

• Name: 1-Octyl-1,2-dihydro-5H-tetrazole-5-thione
• Synonyms: 1-Octyl-5-Mercapto-1H-Tetrazole; 5-Mercapto-1-octyltetrazole; Mercaptooctyltetrazole
• Molecular Formula: C₉H₁₈N₄S
• Molecular Weight: 214.33
• CAS Registry Number: 70253-99-5
• SMILES: Sc1nnnn1CCCCCCCC
• InChI: 1S/C9H18N4S/c1-2-3-4-5-6-7-8-13-9(14)10-11-12-13/h2-8H2,1H3,(H,10,12,14)
• InChIKey: MQSDEYQNRWICCX-UHFFFAOYSA-N

Properties

• Density: 1.18g/cm³ (Cal.)
• Boiling point: 329.313°C at 760 mmHg (Cal.)
• Flash point: 152.964°C (Cal.)