3-{[(1-Ethyl-1H-tetrazol-5-yl)methyl]sulfanyl}propanamide
[CAS# 85697-02-5]

Identification

• Name: 3-{[(1-Ethyl-1H-tetrazol-5-yl)methyl]sulfanyl}propanamide
• Synonyms: 3-(((1-Ethyl-1H-tetrazol-5-yl)methyl)thio)propanamide; 3-(1-Ethyl-1,2,3,4-tetrazol-5-yl)methylthiopropionamide; Propanamide, 3-(((1-ethyl-1H-tetrazol-5-yl)methyl)thio)-
• Molecular Formula: C₇H₁₃N₅OS
• Molecular Weight: 215.28
• CAS Registry Number: 85697-02-5
• SMILES: O=C(N)CCSCc1nnnn1CC
• InChI: 1S/C7H13N5OS/c1-2-12-7(9-10-11-12)5-14-4-3-6(8)13/h2-5H2,1H3,(H2,8,13)
• InChIKey: DLILMAIALIVQNX-UHFFFAOYSA-N

Properties

• Density: 1.441g/cm³ (Cal.)
• Boiling point: 525.243°C at 760 mmHg (Cal.)
• Flash point: 271.458°C (Cal.)