3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate

Base Information

• Chemical Name: 3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate
• CAS No.: 2802-19-9
• Molecular Formula: C26H35 F3 O4
• Molecular Weight: 468.5489096
• European Community (EC) Number: 220-542-3
• DSSTox Substance ID: DTXSID50950708
• Nikkaji Number: J306.747E
• Mol file: 2802-19-9.mol

Synonyms:2802-19-9;3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate;EINECS 220-542-3;3-ethoxy-20-oxo-6-(trifluoromethyl)pregna-3,5-dien-17-yl acetate;DTXSID50950708;C26H35F3O4;C26-H35-F3-O4;Acetic acid 3-ethoxy-20-oxo-6-(trifluoromethyl)pregna-3,5-dien-17-yl ester

Chemical Property of 3-Ethoxy-17-hydroxy-6-(trifluoromethyl)pregna-3,5-diene-20-one acetate

Chemical Property:

• Vapor Pressure: 6.8E-10mmHg at 25°C
• Boiling Point: 493.8°Cat760mmHg
• Flash Point: 243.3°C
• Density: 1.2g/cm³
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 468.24874408
• Heavy Atom Count: 33
• Complexity: 919

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOC1=CC2=C(CC3C(C2(CC1)C)CCC4(C3CCC4(C(=O)C)OC(=O)C)C)C(F)(F)F
• Isomeric SMILES: CCOC1=CC2=C(C[C@@H]3[C@@H]([C@]2(CC1)C)CC[C@]4([C@H]3CC[C@@]4(C(=O)C)OC(=O)C)C)C(F)(F)F

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