Dibutyrylmorphine

Base Information

• Chemical Name: Dibutyrylmorphine
• CAS No.: 66641-03-0
• Molecular Formula: C25H31NO5
• Molecular Weight: 425.5173
• DSSTox Substance ID: DTXSID80985220
• Nikkaji Number: J280.536G
• Wikipedia: Dibutyrylmorphine
• Wikidata: Q25102335

Synonyms:3,6-dibutanoylmorphine

Chemical Property of Dibutyrylmorphine

Chemical Property:

• Vapor Pressure: 1.44E-11mmHg at 25°C
• Boiling Point: 536.2°Cat760mmHg
• Flash Point: 278.1°C
• PSA: 65.07000
• Density: 1.25g/cm³
• LogP: 3.48690
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 425.22022309
• Heavy Atom Count: 31
• Complexity: 752

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1C=CC2C3CC4=C5C2(C1OC5=C(C=C4)OC(=O)CCC)CCN3C
• Isomeric SMILES: CCCC(=O)O[C@H]1C=C[C@H]2[C@H]3CC4=C5[C@]2([C@H]1OC5=C(C=C4)OC(=O)CCC)CCN3C

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