Clocortolone

Base Information

• Chemical Name: Clocortolone
• CAS No.: 34097-16-0
• Molecular Formula: C27H36ClFO5
• Molecular Weight: 495.031
• Hs Code.: 2937220000
• European Community (EC) Number: 225-406-7
• UNII: N8ZUB7XE0H
• DSSTox Substance ID: DTXSID901333489
• Nikkaji Number: J106.513K
• Wikipedia: Clocortolone
• Wikidata: Q5134843
• NCI Thesaurus Code: C61684
• RXCUI: 21249
• Metabolomics Workbench ID: 43124
• Mol file: 34097-16-0.mol

Synonyms:clocortolone;clocortolone acetate

Chemical Property of Clocortolone

Chemical Property:

• Vapor Pressure: 8.58E-17mmHg at 25°C
• Refractive Index: 1.551
• Boiling Point: 597.979 °C at 760 mmHg
• PKA: 13.04±0.70(Predicted)
• Flash Point: 315.447 °C
• PSA: 80.67000
• Density: 1.245 g/cm³
• LogP: 4.59510
• Storage Temp.: Refrigerator, under inert atmosphere
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly)
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 410.1660152
• Heavy Atom Count: 28
• Complexity: 793

Purity/Quality:

99% ^*data from raw suppliers

ClocortolonePivalate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1C(=O)CO)C)O)Cl)C)F
• Isomeric SMILES: C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@H]1C(=O)CO)C)O)Cl)C)F
• Uses: Clocortolone Pivalate is a corticosteroid used in the treatment of atopic dermatitis.

Technology Process of Clocortolone

There total 1 articles about Clocortolone which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ 9-chloro-6α-fluoro-11β,21-dihydroxy-16α-methylpregna-1,4-diene-3,20-dione 21-pivalate (34097-16-0)

Guidance literature:

Entspr. 9(11)-Olefin, tert. Butylhypochlorit;