Halocortolone
[CAS# 24320-27-2]

Identification

• Name: Halocortolone
• Synonyms: (6S,8S,10S,11S,13S,14S,16R,17S)-9-Chloro-6,11-Difluoro-17-(2-Hydroxy-1-Oxoethyl)-10,13,16-Trimethyl-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-3-One; (6S,8S,10S,11S,13S,14S,16R,17S)-9-Chloro-6,11-Difluoro-17-Glycoloyl-10,13,16-Trimethyl-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-3-One; (6S,8S,10S,11S,13S,14S,16R,17S)-9-Chloro-6,11-Difluoro-17-(2-Hydroxyethanoyl)-10,13,16-Trimethyl-7,8,11,12,14,15,16,17-Octahydro-6H-Cyclopenta[A]Phenanthren-3-One
• Molecular Formula: C₂₂H₂₇ClF₂O₃
• Molecular Weight: 412.90
• CAS Registry Number: 24320-27-2
• SMILES: [C@H]23C(Cl)([C@@]1(C(=CC(=O)C=C1)[C@@H](F)C2)C)[C@@H](F)C[C@]4([C@H]3C[C@H]([C@@H]4C(=O)CO)C)C
• InChI: 1S/C22H27ClF2O3/c1-11-6-13-14-8-16(24)15-7-12(27)4-5-21(15,3)22(14,23)18(25)9-20(13,2)19(11)17(28)10-26/h4-5,7,11,13-14,16,18-19,26H,6,8-10H2,1-3H3/t11-,13+,14+,16+,18+,19-,20+,21+,22?/m1/s1
• InChIKey: MBRXSOUHUFBPQC-UZGAULTLSA-N

Properties

• Density: 1.296g/cm³ (Cal.)
• Boiling point: 529.406°C at 760 mmHg (Cal.)
• Flash point: 273.975°C (Cal.)