Alfathesin

Base Information

• Chemical Name: Alfathesin
• CAS No.: 8067-82-1
• Molecular Formula: C23H34O5•C21H32O3
• Molecular Weight: 723.10
• DSSTox Substance ID: DTXSID001001405
• Wikipedia: Alfaxolone/alfadolone
• Wikidata: Q4721889
• Mol file: 8067-82-1.mol

Synonyms:Alfadolone Mixture, Alfaxalone;Alfatesine;Alfathesin;Alfaxalone Alfadolone Mixture;Alphadione;Alphathesin;Althesin;CT 1341;CT-1341;CT1341;Glaxovet;Saffan

Chemical Property of Alfathesin

Chemical Property:

• Vapor Pressure: 3.75E-13mmHg at 25°C
• Boiling Point: 523.6°C at 760 mmHg
• Flash Point: 175.1°C
• PSA: 135.04000
• LogP: 7.09160
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 722.47576906
• Heavy Atom Count: 52
• Complexity: 1260

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1CCC2C1(CC(=O)C3C2CCC4C3(CCC(C4)O)C)C.CC(=O)OCC(=O)C1CCC2C1(CC(=O)C3C2CCC4C3(CCC(C4)O)C)C
• Isomeric SMILES: CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C.CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C