Diethyl (3-hydroxy-20-oxopregn-5-en-16-yl)phosphonate

Base Information

• Chemical Name: Diethyl (3-hydroxy-20-oxopregn-5-en-16-yl)phosphonate
• CAS No.: 14413-01-5
• Molecular Formula: C₂₅H₄₁O₅P
• Molecular Weight: 452.571
• NSC Number: 77620
• DSSTox Substance ID: DTXSID40932235
• Mol file: 14413-01-5.mol

Synonyms:14413-01-5;NSC77620;Diethyl (3-hydroxy-20-oxopregn-5-en-16-yl)phosphonate;DTXSID40932235;NSC-77620

Chemical Property of Diethyl (3-hydroxy-20-oxopregn-5-en-16-yl)phosphonate

Chemical Property:

• Vapor Pressure: 4.18E-15mmHg at 25°C
• Boiling Point: 564.7°Cat760mmHg
• Flash Point: 295.3°C
• Density: 1.15g/cm³
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 452.26916140
• Heavy Atom Count: 31
• Complexity: 783

Purity/Quality:

99.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOP(=O)(C1CC2C3CC=C4CC(CCC4(C3CCC2(C1C(=O)C)C)C)O)OCC

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