(5Z,11alpha,13E)-15-Fluoro-11-hydroxy-9-oxoprosta-5,13-dien-1-oic acid
[CAS# 88736-32-7]

Identification

• Name: (5Z,11alpha,13E)-15-Fluoro-11-hydroxy-9-oxoprosta-5,13-dien-1-oic acid
• Synonyms: 15-Fluoro-15-deoxyprostaglandin E2; 15-F-PGE2
• Molecular Formula: C₂₀H₃₁FO₄
• Molecular Weight: 354.46
• CAS Registry Number: 88736-32-7
• SMILES: O=C1C[C@@H](O)[C@H](/C=C/C(F)CCCCC)[C@H]1C\C=C/CCCC(=O)O
• InChI: 1S/C20H31FO4/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15?,16-,17-,19-/m1/s1
• InChIKey: NYMVAZYCTAFPMH-COHNOYJASA-N

Properties

• Density: 1.126g/cm³ (Cal.)
• Boiling point: 505.148°C at 760 mmHg (Cal.)
• Flash point: 259.304°C (Cal.)