6beta-Hydroxycortisol

Base Information

• Chemical Name: 6beta-Hydroxycortisol
• CAS No.: 53-35-0
• Molecular Formula: C₂₁H₃₀O₆
• Molecular Weight: 378.466
• NSC Number: 76163
• UNII: J37WKJ5Y50
• DSSTox Substance ID: DTXSID80425873
• Nikkaji Number: J431.691F
• Wikipedia: 6%CE%B2-Hydroxycortisol
• Wikidata: Q63393460
• Metabolomics Workbench ID: 200423
• ChEMBL ID: CHEMBL1389133
• Mol file: 53-35-0.mol

Synonyms:6 beta-hydroxycortisol;6beta-hydroxycortisol

Chemical Property of 6beta-Hydroxycortisol

Chemical Property:

• Vapor Pressure: 4.69E-18mmHg at 25°C
• Melting Point: 182-190?C
• Boiling Point: 621.6°Cat760mmHg
• Flash Point: 343.7°C
• PSA: 115.06000
• Density: 1.32g/cm³
• LogP: 0.75240
• Storage Temp.: Refrigerator
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 378.20423867
• Heavy Atom Count: 27
• Complexity: 716

Purity/Quality:

97% ^*data from raw suppliers

6-BETA-HYDROXYCORTISOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC(=O)C=C1C(CC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O)O
• Isomeric SMILES: C[C@]12CCC(=O)C=C1[C@@H](C[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C)O)O
• Uses: A metabolite of Cortisol

Technology Process of 6beta-Hydroxycortisol

There total 2 articles about 6beta-Hydroxycortisol 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:

→ 6β-Hydroxy-cortisol (53-35-0,2242-98-0,3078-34-0,130465-13-3)

Guidance literature:

Aus 6β,21-Diacetoxy-11β,17α-dihydroxy-pregn-4-en-3,20-dion + wss.-methanol. K2CO3;

Reference yield:

→ 6α,11β,17α,21-Tetrahydroxy-pregn-4-en-3,20-dion (53-35-0,2242-98-0,3078-34-0,130465-13-3)

Guidance literature:

Aus 6α,21-Diacetoxy-11β,17α-dihydroxy-pregn-4-en-3,20-dion + wss.-methanol. K2CO3 oder KOH;