2-Methyl-1H-indol-3-yl carbamimidothioate
[CAS# 72610-15-2]

Identification

• Name: 2-Methyl-1H-indol-3-yl carbamimidothioate
• Synonyms: 2-(2-Methyl-1H-indol-3-yl)-isothiourea; 2-(2-Methyl-1H-indol-3-yl)-isothiourea hydroiodide; BAS 01027225
• Molecular Formula: C₁₀H₁₁N₃S
• Molecular Weight: 205.28
• CAS Registry Number: 72610-15-2
• SMILES: [N@H]=C(Sc2c1ccccc1nc2C)N
• InChI: 1S/C10H11N3S/c1-6-9(14-10(11)12)7-4-2-3-5-8(7)13-6/h2-5,13H,1H3,(H3,11,12)
• InChIKey: ZPRYXKKXQDEZCP-UHFFFAOYSA-N

Properties

• Density: 1.383g/cm³ (Cal.)
• Boiling point: 401.961°C at 760 mmHg (Cal.)
• Flash point: 196.899°C (Cal.)