16-Hydroxy-16-Methyl-9-Oxo-Prosta-10,13-Dien-1-Oic Acid Methyl Ester
[CAS# 58682-86-3]

Identification

• Name: 16-Hydroxy-16-Methyl-9-Oxo-Prosta-10,13-Dien-1-Oic Acid Methyl Ester
• Synonyms: Methyl 7-[(1R,2S)-2-[(E)-4-Hydroxy-4-Methyl-Oct-1-Enyl]-5-Oxo-1-Cyclopent-3-Enyl]Heptanoate; 7-[(1R,2S)-2-[(E)-4-Hydroxy-4-Methyloct-1-Enyl]-5-Oxo-1-Cyclopent-3-Enyl]Heptanoic Acid Methyl Ester; 7-[(1R,2S)-2-[(E)-4-Hydroxy-4-Methyl-Oct-1-Enyl]-5-Keto-1-Cyclopent-3-Enyl]Enanthic Acid Methyl Ester
• Molecular Formula: C₂₂H₃₆O₄
• Molecular Weight: 364.52
• CAS Registry Number: 58682-86-3
• SMILES: [C@H]1([C@H](C=CC1=O)\C=C\CC(O)(CCCC)C)CCCCCCC(OC)=O
• InChI: 1S/C22H36O4/c1-4-5-16-22(2,25)17-10-11-18-14-15-20(23)19(18)12-8-6-7-9-13-21(24)26-3/h10-11,14-15,18-19,25H,4-9,12-13,16-17H2,1-3H3/b11-10+/t18-,19+,22?/m0/s1
• InChIKey: OCWJVIUDOHXKHI-PWNUKQCCSA-N

Properties

• Density: 1.038g/cm³ (Cal.)
• Boiling point: 479.125°C at 760 mmHg (Cal.)
• Flash point: 154.765°C (Cal.)