2-(3-Heptanyl)-3-Methyl-2,3-Dihydro-1,3-Benzothiazole
[CAS# 104169-07-5]

Identification

• Name: 2-(3-Heptanyl)-3-Methyl-2,3-Dihydro-1,3-Benzothiazole
• Synonyms: 2-(heptan-3-yl)-3-methyl-2,3-dihydrobenzo[d]thiazole
• Molecular Formula: C₁₅H₂₃NS
• Molecular Weight: 249.41
• CAS Registry Number: 104169-07-5
• SMILES: CCCCC(CC)C1N(c2ccccc2S1)C
• InChI: 1S/C15H23NS/c1-4-6-9-12(5-2)15-16(3)13-10-7-8-11-14(13)17-15/h7-8,10-12,15H,4-6,9H2,1-3H3
• InChIKey: KRQGGVCQVXLFFR-UHFFFAOYSA-N

Properties

• Density: 1.009g/cm³ (Cal.)
• Boiling point: 342.028°C at 760 mmHg (Cal.)
• Flash point: 160.653°C (Cal.)
• Refractive index: 1.544 (Cal.)