15alpha-Hydroxycortexone

Base Information

• Chemical Name: 15alpha-Hydroxycortexone
• CAS No.: 599-17-7
• Molecular Formula: C21H30O4
• Molecular Weight: 346.4605
• NSC Number: 82877
• Nikkaji Number: J247.832C
• Mol file: 599-17-7.mol

Synonyms:MLS002694141;599-17-7;NSC82877;NSC-82877

Chemical Property of 15alpha-Hydroxycortexone

Chemical Property:

• Vapor Pressure: 2.07E-13mmHg at 25°C
• Boiling Point: 529.2°Cat760mmHg
• Flash Point: 288°C
• PSA: 74.60000
• Density: 1.21g/cm³
• LogP: 2.66670
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 346.21440943
• Heavy Atom Count: 25
• Complexity: 638

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCC(=O)C=C1CCC3C2CCC4(C3C(CC4C(=O)CO)O)C
• Isomeric SMILES: C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3[C@H](C[C@@H]4C(=O)CO)O)C