2,2,4-Trimethyl-2,3,4,5-Tetrahydro-1,5-Benzothiazepine
[CAS# 13338-13-1]

Identification

• Name: 2,2,4-Trimethyl-2,3,4,5-Tetrahydro-1,5-Benzothiazepine
• Synonyms: 2,2,4-Trimethyl-2,3,4,5-tetrahydro-1,5-benzothiazepine #
• Molecular Formula: C₁₂H₁₇NS
• Molecular Weight: 207.34
• CAS Registry Number: 13338-13-1
• SMILES: S2c1ccccc1NC(CC2(C)C)C
• InChI: 1S/C12H17NS/c1-9-8-12(2,3)14-11-7-5-4-6-10(11)13-9/h4-7,9,13H,8H2,1-3H3
• InChIKey: URHIRPNXXQDFFA-UHFFFAOYSA-N

Properties

• Density: 0.997g/cm³ (Cal.)
• Boiling point: 304.557°C at 760 mmHg (Cal.)
• Flash point: 137.992°C (Cal.)
• Refractive index: 1.527 (Cal.)