7-(6-(3-Hydroxy-1-octenyl)-2,3-diazabicyclo(2.2.1)hept-2-en-5-yl)-5-Heptenoic acid
[CAS# 67901-99-9]

Identification

• Name: 7-(6-(3-Hydroxy-1-octenyl)-2,3-diazabicyclo(2.2.1)hept-2-en-5-yl)-5-Heptenoic acid
• Synonyms: (15S)-Hydroxy-9Alpha,11Alpha-Azoprosta-5Z,13E-Dienoic Acid; (5Z,9Alpha,11Alpha,13E,15S)-9,11-Azo-15-Hydroxyprosta-5,13-Dienoic Acid; 15-Hydroxy-9,11-Azoprostanoid
• Molecular Formula: C₂₀H₃₂N₂O₃
• Molecular Weight: 348.48
• CAS Registry Number: 67901-99-9
• SMILES: [C@@H]12N=N[C@@H]([C@@H]([C@H]1\C=C\[C@@H](O)CCCCC)C\C=C/CCCC(=O)O)C2
• InChI: 1S/C20H32N2O3/c1-2-3-6-9-15(23)12-13-17-16(18-14-19(17)22-21-18)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18+,19-/m0/s1
• InChIKey: XBVVXCYNLAIXKD-WTKFZEAQSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 505.122°C at 760 mmHg (Cal.)
• Flash point: 259.289°C (Cal.)