17-Hydroxy-3,11,20-trioxopregn-4-en-21-yl 2-(aziridin-1-yl)-3,5-dinitrobenzoate

Base Information

• Chemical Name: 17-Hydroxy-3,11,20-trioxopregn-4-en-21-yl 2-(aziridin-1-yl)-3,5-dinitrobenzoate
• CAS No.: 24147-56-6
• Molecular Formula: C30H33 N3 O10
• Molecular Weight: 595.5971
• NSC Number: 106558
• DSSTox Substance ID: DTXSID80946972
• Mol file: 24147-56-6.mol

Synonyms:24147-56-6;NSC106558;17-hydroxy-3,11,20-trioxopregn-4-en-21-yl 2-(aziridin-1-yl)-3,5-dinitrobenzoate;DTXSID80946972;NSC-106558

Chemical Property of 17-Hydroxy-3,11,20-trioxopregn-4-en-21-yl 2-(aziridin-1-yl)-3,5-dinitrobenzoate

Chemical Property:

• Vapor Pressure: 1.17E-28mmHg at 25°C
• Boiling Point: 822.8°Cat760mmHg
• Flash Point: 451.4°C
• Density: 1.48g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 6
• Exact Mass: 595.21659426
• Heavy Atom Count: 43
• Complexity: 1320

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4(C(=O)COC(=O)C5=C(C(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-])N6CC6)O)C

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