2-alpha-Chloro-5-alpha-androstane-3,17-dione 3-(O-(p-nitrophenyl)oxime)

Base Information

• Chemical Name: 2-alpha-Chloro-5-alpha-androstane-3,17-dione 3-(O-(p-nitrophenyl)oxime)
• CAS No.: 51354-33-7
• Molecular Formula: C25H31ClN2O4
• Molecular Weight: 458.9776

Synonyms:BRN 2229337;2-alpha-Chloro-5-alpha-androstane-3,17-dione 3-(O-(p-nitrophenyl)oxime);5-alpha-ANDROSTANE-3,17-DIONE, 2-alpha-CHLORO-, 3-(O-(p-NITROPHENYL)OXIME);C25H31ClN2O4;C25-H31-Cl-N2-O4;51354-33-7;LS-19358

Chemical Property of 2-alpha-Chloro-5-alpha-androstane-3,17-dione 3-(O-(p-nitrophenyl)oxime)

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 586.1°Cat760mmHg
• Flash Point: 308.2°C
• PSA: 84.48000
• Density: 1.41g/cm³
• LogP: 6.68190
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 458.1972352
• Heavy Atom Count: 32
• Complexity: 804

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC3C(C1CCC2=O)CCC4C3(CC(C(=NOC5=CC=C(C=C5)[N+](=O)[O-])C4)Cl)C
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC[C@@H]4[C@@]3(C[C@H](/C(=N/OC5=CC=C(C=C5)[N+](=O)[O-])/C4)Cl)C

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