(1R,7R,8S,9S)-7,9-Dihydroxy-5-azatricyclo[6.3.1.0^1,5]dodecan-4-one
[CAS# 749861-39-0]

Identification

• Name: (1R,7R,8S,9S)-7,9-Dihydroxy-5-azatricyclo[6.3.1.0^1,5]dodecan-4-one
• Synonyms: (6R,7S,8S,10aR)-6,8-dihydroxyhexahydro-1H-7,10a-methanopyrrolo[1,2-a]azocin-3(2H)-one
• Molecular Formula: C₁₁H₁₇NO₃
• Molecular Weight: 211.26
• CAS Registry Number: 749861-39-0
• SMILES: C1C[C@]23CCC(=O)N2C[C@@H]([C@@H](C3)[C@H]1O)O
• InChI: 1S/C11H17NO3/c13-8-1-3-11-4-2-10(15)12(11)6-9(14)7(8)5-11/h7-9,13-14H,1-6H2/t7-,8-,9-,11+/m0/s1
• InChIKey: XBNRREHLLQWGHP-FTYOSLGDSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 441.1±45.0°C at 760 mmHg (Cal.)
• Flash point: 220.6±28.7°C (Cal.)
• Refractive index: 1.611 (Cal.)