4,4,5,5,5-Pentafluoro-1-(4-fluoro-3-methoxyphenyl)pentane-1,3-dione

Base Information

• Chemical Name: 4,4,5,5,5-Pentafluoro-1-(4-fluoro-3-methoxyphenyl)pentane-1,3-dione
• CAS No.: 64287-14-5
• Molecular Formula: C12H8F6O3
• DSSTox Substance ID: DTXSID80544972
• Wikidata: Q82422301

Synonyms:64287-14-5;4,4,5,5,5-Pentafluoro-1-(4-fluoro-3-methoxyphenyl)pentane-1,3-dione;DTXSID80544972

Chemical Property of 4,4,5,5,5-Pentafluoro-1-(4-fluoro-3-methoxyphenyl)pentane-1,3-dione

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 314.03776309
• Heavy Atom Count: 21
• Complexity: 406

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)C(=O)CC(=O)C(C(F)(F)F)(F)F)F

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