17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime

Base Information

• Chemical Name: 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime
• CAS No.: 64584-79-8
• Molecular Formula: C26H30 N2 O4
• Molecular Weight: 434.53
• Mol file: 64584-79-8.mol

Synonyms:17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime;19-Nor-17-alpha-pregn-4-en-20-yn-3-one, 17-hydroxy-, O-(p-nitrophenyl)oxime;64584-79-8;LS-97441

Chemical Property of 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one O-(p-nitrophenyl)oxime

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 584.906°C at 760 mmHg
• Flash Point: 307.54°C
• PSA: 87.64000
• Density: 1.313g/cm³
• LogP: 5.78980
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 434.22055744
• Heavy Atom Count: 32
• Complexity: 874

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=NOC5=CC=C(C=C5)[N+](=O)[O-])CCC34
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#C)O)CCC4=C/C(=N\OC5=CC=C(C=C5)[N+](=O)[O-])/CC[C@H]34

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