3,20,22-Trihydroxy-6-oxocholesta-4,7-dien-2-yl acetate

Base Information

• Chemical Name: 3,20,22-Trihydroxy-6-oxocholesta-4,7-dien-2-yl acetate
• CAS No.: 7233-35-4
• Molecular Formula: C29H44O6
• Molecular Weight: 488.6561
• DSSTox Substance ID: DTXSID60413177
• Wikidata: Q82221048

Synonyms:7233-35-4;3,20,22-Trihydroxy-6-oxocholesta-4,7-dien-2-yl acetate;DTXSID60413177

Chemical Property of 3,20,22-Trihydroxy-6-oxocholesta-4,7-dien-2-yl acetate

Chemical Property:

• Vapor Pressure: 4.41E-19mmHg at 25°C
• Boiling Point: 640.1°C at 760 mmHg
• Flash Point: 204.5°C
• Density: 1.18g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 488.31378912
• Heavy Atom Count: 35
• Complexity: 936

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCC(C(C)(C1CCC2C1(CCC3C2=CC(=O)C4=CC(C(CC34C)OC(=O)C)O)C)O)O

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