(5Z,13E,15S)-2,2-Difluoro-9alpha,11alpha,15-Trihydroxy-15-Methylprosta-5,13-Dien-1-Oic Acid 1,9-Lactone
[CAS# 62443-67-8]

Identification

• Name: (5Z,13E,15S)-2,2-Difluoro-9alpha,11alpha,15-Trihydroxy-15-Methylprosta-5,13-Dien-1-Oic Acid 1,9-Lactone
• Synonyms: (Z)-7-[(1R,2R,5R)-3,5-Dihydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-1-Cyclopent-3-Enyl]-2,2-Difluoro-Hept-5-Enal; Brn 5630294; Prosta-5,13-Dien-1-Oic Acid, 2,2-Difluoro-9,11,15-Trihydroxy-15-Methyl-, Theta-Lactone, (5Z,9-Alpha,11-Alpha,13E,15S)-
• Molecular Formula: C₂₁H₃₂F₂O₄
• Molecular Weight: 386.48
• CAS Registry Number: 62443-67-8
• SMILES: [C@H]1(C\C=C/CCC(C=O)(F)F)[C@H](C=C([C@@H]1\C=C\[C@@](CCCCC)(C)O)O)O
• InChI: 1S/C21H32F2O4/c1-3-4-7-11-20(2,27)13-10-17-16(18(25)14-19(17)26)9-6-5-8-12-21(22,23)15-24/h5-6,10,13-18,25-27H,3-4,7-9,11-12H2,1-2H3/b6-5-,13-10+/t16-,17-,18+,20+/m1/s1
• InChIKey: SUXLXMYSAGMHCK-UJBRBZCOSA-N

Properties

• Density: 1.177g/cm³ (Cal.)
• Boiling point: 496.322°C at 760 mmHg (Cal.)
• Flash point: 253.967°C (Cal.)