(3aR,9bS)-1-Methyl-1,2,3,3a,4,9b-hexahydrothiochromeno[4,3-b]pyrrol-6-ol
[CAS# 805246-35-9]

Identification

• Name: (3aR,9bS)-1-Methyl-1,2,3,3a,4,9b-hexahydrothiochromeno[4,3-b]pyrrol-6-ol
• Synonyms: (3aR,9bS)-1-methyl-1,2,3,3a,4,9b-hexahydrothiochromeno[4,3-b]pyrrol-6-ol
• Molecular Formula: C₁₂H₁₅NOS
• Molecular Weight: 221.32
• CAS Registry Number: 805246-35-9
• SMILES: Oc2c1SC[C@@H]3CCN([C@@H]3c1ccc2)C
• InChI: 1S/C12H15NOS/c1-13-6-5-8-7-15-12-9(11(8)13)3-2-4-10(12)14/h2-4,8,11,14H,5-7H2,1H3/t8-,11-/m0/s1
• InChIKey: MTHLDRQCFALTBC-KWQFWETISA-N

Properties

• Density: 1.233g/cm³ (Cal.)
• Boiling point: 312.035°C at 760 mmHg (Cal.)
• Flash point: 142.514°C (Cal.)
• Refractive index: 1.632 (Cal.)