Chloroprednisone
[CAS# 52080-57-6]

Identification

• Name: Chloroprednisone
• Synonyms: (6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-17-(2-Hydroxy-1-Oxoethyl)-10,13-Dimethyl-6,7,8,9,12,14,15,16-Octahydrocyclopenta[A]Phenanthrene-3,11-Dione; (6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Glycoloyl-17-Hydroxy-10,13-Dimethyl-6,7,8,9,12,14,15,16-Octahydrocyclopenta[A]Phenanthrene-3,11-Quinone; (6S,8S,9S,10R,13S,14S,17R)-6-Chloro-17-Hydroxy-17-(2-Hydroxyethanoyl)-10,13-Dimethyl-6,7,8,9,12,14,15,16-Octahydrocyclopenta[A]Phenanthrene-3,11-Dione
• Molecular Formula: C₂₁H₂₅ClO₅
• Molecular Weight: 392.88
• CAS Registry Number: 52080-57-6
• EINECS: 257-644-2
• SMILES: [C@H]24[C@H]1[C@@]([C@](O)(CC1)C(=O)CO)(CC(=O)[C@@H]2[C@@]3(C(=CC(=O)C=C3)[C@@H](Cl)C4)C)C
• InChI: 1S/C21H25ClO5/c1-19-5-3-11(24)7-14(19)15(22)8-12-13-4-6-21(27,17(26)10-23)20(13,2)9-16(25)18(12)19/h3,5,7,12-13,15,18,23,27H,4,6,8-10H2,1-2H3/t12-,13-,15-,18+,19-,20-,21-/m0/s1
• InChIKey: NPSLCOWKFFNQKK-ZPSUVKRCSA-N

Properties

• Density: 1.376g/cm³ (Cal.)
• Boiling point: 608.41°C at 760 mmHg (Cal.)
• Flash point: 321.755°C (Cal.)