N-(1,3-Benzodioxol-5-ylmethyl)carbamohydrazonothioic acid
[CAS# 206761-70-8]

Identification

• Name: N-(1,3-Benzodioxol-5-ylmethyl)carbamohydrazonothioic acid
• Synonyms: [(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)amino]hydrazinomethane-1-thione; 4-(3,4-Methylenedioxybenzyl)-3-thiosemicarbazide; HYDRAZINECARBOTHIOAMIDE,N-(1,3-BENZODIOXOL-5-YLMETHYL)-
• Molecular Formula: C₉H₁₁N₃O₂S
• Molecular Weight: 225.27
• CAS Registry Number: 206761-70-8
• SMILES: C1OC2=C(O1)C=C(C=C2)CNC(=NN)S
• InChI: 1S/C9H11N3O2S/c10-12-9(15)11-4-6-1-2-7-8(3-6)14-5-13-7/h1-3H,4-5,10H2,(H2,11,12,15)
• InChIKey: QDNGFJROOVPDTK-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Melting point: 158-160°C (Expl.)
• Boiling point: 392.1±52.0°C at 760 mmHg (Cal.)
• Flash point: 191.0±30.7°C (Cal.)
• Refractive index: 1.695 (Cal.)

Safety Data

• Safety Description: IRRITANT