Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxymethyl-

Base Information

• Chemical Name: Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxymethyl-
• CAS No.: 1323-45-1
• Molecular Formula: C23H30O5
• Molecular Weight: 386.4813
• DSSTox Substance ID: DTXSID00157467
• Wikidata: Q83025606
• Mol file: 1323-45-1.mol

Synonyms:Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxymethyl-;1323-45-1;DTXSID00157467

Chemical Property of Pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxymethyl-

Chemical Property:

• Vapor Pressure: 8.17E-17mmHg at 25°C
• Boiling Point: 598.4°Cat760mmHg
• Flash Point: 329.7°C
• Density: 1.26g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 386.20932405
• Heavy Atom Count: 28
• Complexity: 795

Purity/Quality:

99% ，98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CC(=O)C3C(C1CCC2(CO)C(=O)CCO)CCC4=CC(=O)C=CC34C
• Isomeric SMILES: C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CC[C@]2(CO)C(=O)CCO)CCC4=CC(=O)C=C[C@]34C