Methyl (1R,5S,6R)-9-methyl-7-oxo-3-thia-9-azabicyclo[3.3.1]nonane-6-carboxylate
[CAS# 790697-01-7]

Identification

• Name: Methyl (1R,5S,6R)-9-methyl-7-oxo-3-thia-9-azabicyclo[3.3.1]nonane-6-carboxylate
• Synonyms: (1R,5S,6R)-methyl 9-methyl-7-oxo-3-thia-9-azabicyclo[3.3.1]nonane-6-carboxylate
• Molecular Formula: C₁₀H₁₅NO₃S
• Molecular Weight: 229.30
• CAS Registry Number: 790697-01-7
• SMILES: CN1[C@@H]2CC(=O)[C@@H]([C@H]1CSC2)C(=O)OC
• InChI: 1S/C10H15NO3S/c1-11-6-3-8(12)9(10(13)14-2)7(11)5-15-4-6/h6-7,9H,3-5H2,1-2H3/t6-,7-,9-/m1/s1
• InChIKey: FZTBADAUAGZOSI-ZXFLCMHBSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 358.6±42.0°C at 760 mmHg (Cal.)
• Flash point: 170.7±27.9°C (Cal.)
• Refractive index: 1.537 (Cal.)