19-Amino-4-androstene-3,17-dione

Base Information

• Chemical Name: 19-Amino-4-androstene-3,17-dione
• CAS No.: 87994-68-1
• Molecular Formula: C19H27NO2
• Molecular Weight: 301.4232
• DSSTox Substance ID: DTXSID801007895
• Wikidata: Q83004173
• Mol file: 87994-68-1.mol

Synonyms:19-AADO;19-amino-4-androstene-3,17-dione

Chemical Property of 19-Amino-4-androstene-3,17-dione

Chemical Property:

• Vapor Pressure: 4.6E-09mmHg at 25°C
• Boiling Point: 471.6°Cat760mmHg
• Flash Point: 239°C
• PSA: 60.16000
• Density: 1.16g/cm³
• LogP: 3.72650
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 301.204179104
• Heavy Atom Count: 22
• Complexity: 566

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC3C(C1CCC2=O)CCC4=CC(=O)CCC34CN
• Isomeric SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@]34CN

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