17-Hydroxy-6-methyl-3,20-dioxopregna-1,4,9(11)-trien-21-yl acetate

Base Information

• Chemical Name: 17-Hydroxy-6-methyl-3,20-dioxopregna-1,4,9(11)-trien-21-yl acetate
• CAS No.: 93239-37-3
• Molecular Formula: C24H30 O5
• Molecular Weight: 398.499
• NSC Number: 86007
• DSSTox Substance ID: DTXSID00918590
• ChEMBL ID: CHEMBL1699279
• Mol file: 93239-37-3.mol

Synonyms:MLS002694663;93239-37-3;17-hydroxy-6-methyl-3,20-dioxopregna-1,4,9(11)-trien-21-yl acetate;NSC86007;NCIOpen2_009332;CHEMBL1699279;DTXSID00918590;HMS3087G21;NSC-86007;[2-(17-hydroxy-6,10,13-trimethyl-3-oxo-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate;SMR001560588

Chemical Property of 17-Hydroxy-6-methyl-3,20-dioxopregna-1,4,9(11)-trien-21-yl acetate

Chemical Property:

• Vapor Pressure: 7.12E-15mmHg at 25°C
• Boiling Point: 560°Cat760mmHg
• Flash Point: 189.6°C
• Density: 1.22g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 398.20932405
• Heavy Atom Count: 29
• Complexity: 880

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2C3CCC(C3(CC=C2C4(C1=CC(=O)C=C4)C)C)(C(=O)COC(=O)C)O