(5Z)-7-{(1R,2S)-2-[(3R)-3-Hydroxy-4-Phenoxy-1-Buten-1-Yl]-5-Oxo-3-Cyclopenten-1-Yl}-5-Heptenoic Acid
[CAS# 51639-10-2]

Identification

• Name: (5Z)-7-{(1R,2S)-2-[(3R)-3-Hydroxy-4-Phenoxy-1-Buten-1-Yl]-5-Oxo-3-Cyclopenten-1-Yl}-5-Heptenoic Acid
• Synonyms: "9-oxo-15R-hydroxy-16-phenoxy-17,18,19,20-tetranor-prosta-5Z,10,13E-trien-1-oic acid"; 16-phenoxy tetranor Prostaglandin A2
• Molecular Formula: C₂₂H₂₆O₅
• Molecular Weight: 370.44
• CAS Registry Number: 51639-10-2
• SMILES: C1=CC=C(C=C1)OC[C@@H](C=C[C@H]2C=CC(=O)[C@@H]2C/C=C\CCCC(=O)O)O
• InChI: 1S/C22H26O5/c23-18(16-27-19-8-4-3-5-9-19)14-12-17-13-15-21(24)20(17)10-6-1-2-7-11-22(25)26/h1,3-6,8-9,12-15,17-18,20,23H,2,7,10-11,16H2,(H,25,26)/b6-1-,14-12?/t17-,18+,20+/m0/s1
• InChIKey: CARGFWOXPNIAKB-DRHAACJKSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 591.7±50.0°C at 760 mmHg (Cal.)
• Flash point: 205.4±23.6°C (Cal.)