19-Oxotestosterone

Base Information

• Chemical Name: 19-Oxotestosterone
• CAS No.: 4075-13-2
• Molecular Formula: C₁₉H₂₆O₃
• Molecular Weight: 302.414
• DSSTox Substance ID: DTXSID501020616
• Nikkaji Number: J1.968.925E
• Wikidata: Q27105040
• Mol file: 4075-13-2.mol

Synonyms:19-Oxotestosterone;4075-13-2;19-Aldotestosterone;(8S,9S,10S,13S,14S,17S)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde;(8R,9S,10R,13S,14R,17R)-17-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one;19-aldehyde-testosterone;19-OXO-TESTOSTERONE;SCHEMBL1332182;CHEBI:75308;DTXSID501020616;C05295;(17beta)-17-hydroxy-3-oxoandrost-4-en-19-al;Q27105040

Chemical Property of 19-Oxotestosterone

Chemical Property:

• Vapor Pressure: 6.78E-11mmHg at 25°C
• Boiling Point: 472.1°C at 760 mmHg
• Flash Point: 253.4°C
• PSA: 37.30000
• Density: 1.19g/cm³
• LogP: 3.87920
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 302.18819469
• Heavy Atom Count: 22
• Complexity: 551

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC3C(C1CCC2O)CCC4=CC(=O)CCC34C=O
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@]34C=O
• Uses: 19-Aldotestosterone, is the metabolite of is a metabolite of Testosterone (T155000), the principal hormone of the testes, produced by the interstitial cells.

Technology Process of 19-Oxotestosterone

There total 3 articles about 19-Oxotestosterone 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:

→ 3-oxo-17β-hydroxyandrost-4-en-19-al (4075-13-2)

Guidance literature:

Reference yield:

→ 3,19-Dioxo-17β-hydroxy-androst-4-en (4075-13-2,77101-36-1)

Guidance literature:

3,19-Dioxo-17β-O--androst-4-en (VIII), konz. HCl, A., Δ;

DOI:10.1021/jo01059a536

Reference yield:

→ 17-Hydroxy-13-methyl-3-oxo-1,2,3,6,7,8,9,11,12,13,14,15,16,17-tetradecahydro-cyclopenta[a]phenanthrene-10-carbaldehyde (4075-13-2,77101-36-1)

Guidance literature:

entspr. Hydroxi-17β-(2'-tetrahydropyranyloxi)-Verb., Jones Reagenz;

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