16,16-Dimethyl Prostaglandin A1
[CAS# 41692-24-4]

Identification

• Name: 16,16-Dimethyl Prostaglandin A1
• Synonyms: 7-[(1R,2S)-2-[(E,3R)-3-Hydroxy-4,4-Dimethyl-Oct-1-Enyl]-5-Oxo-1-Cyclopent-3-Enyl]Heptanoic Acid; 7-[(1R,2S)-2-[(E,3R)-3-Hydroxy-4,4-Dimethyl-Oct-1-Enyl]-5-Keto-1-Cyclopent-3-Enyl]Enanthic Acid; 16,16-Dime-Pga1
• Molecular Formula: C₂₂H₃₆O₄
• Molecular Weight: 364.52
• CAS Registry Number: 41692-24-4
• SMILES: [C@H]1([C@H](C=CC1=O)\C=C\[C@@H](O)C(CCCC)(C)C)CCCCCCC(=O)O
• InChI: 1S/C22H36O4/c1-4-5-16-22(2,3)20(24)15-13-17-12-14-19(23)18(17)10-8-6-7-9-11-21(25)26/h12-15,17-18,20,24H,4-11,16H2,1-3H3,(H,25,26)/b15-13+/t17-,18-,20-/m1/s1
• InChIKey: CTQQHQGBBMYJPT-DZFVFWAGSA-N

Properties

• Density: 1.064g/cm³ (Cal.)
• Boiling point: 522.99°C at 760 mmHg (Cal.)
• Flash point: 284.174°C (Cal.)