1,4,5-Trimethyl-1,3,4,5-Tetrahydro-2H-1,5-Benzodiazepine-2-Thione
[CAS 123229-21-0]

Identification

• Name: 1,4,5-Trimethyl-1,3,4,5-Tetrahydro-2H-1,5-Benzodiazepine-2-Thione
• Synonyms: 1,4,5-trimethyl-4,5-dihydro-1H-benzo[b][1,4]diazepine-2(3H)-thione
• Molecular Formula: C₁₂H₁₆N₂S
• Molecular Weight: 220.33
• CAS Registry Number: 123229-21-0
• SMILES: CN2c1ccccc1N(C)C(C)CC2=S
• InChI: 1S/C12H16N2S/c1-9-8-12(15)14(3)11-7-5-4-6-10(11)13(9)2/h4-7,9H,8H2,1-3H3
• InChIKey: MIVROBKMBDEALC-UHFFFAOYSA-N

Properties

• Density: 1.169g/cm³ (Cal.)
• Boiling point: 318.974°C at 760 mmHg (Cal.)
• Flash point: 146.711°C (Cal.)
• Refractive index: 1.633 (Cal.)