S-Propan-2-Yl Azepane-1-Carbothioate
[CAS# 3134-70-1]

Identification

• Name: S-Propan-2-Yl Azepane-1-Carbothioate
• Synonyms: S-Isopropyl Azepane-1-Carbothioate; 1-Azepanecarbothioic Acid S-Isopropyl Ester; Azepane-1-Carbothioic Acid S-Isopropyl Ester
• Molecular Formula: C₁₀H₁₉NOS
• Molecular Weight: 201.33
• CAS Registry Number: 3134-70-1
• EINECS: 221-531-6
• SMILES: CC(SC(=O)N1CCCCCC1)C
• InChI: 1S/C10H19NOS/c1-9(2)13-10(12)11-7-5-3-4-6-8-11/h9H,3-8H2,1-2H3
• InChIKey: LMHHRCOWPQNFTF-UHFFFAOYSA-N

Properties

• Density: 1.039g/cm³ (Cal.)
• Boiling point: 289.341°C at 760 mmHg (Cal.)
• Flash point: 128.789°C (Cal.)