1,3-Bis(3-oxaperfluoro-2-hexyl)-1,3-propanedione

Base Information

• Chemical Name: 1,3-Bis(3-oxaperfluoro-2-hexyl)-1,3-propanedione
• CAS No.: 87405-74-1
• Molecular Formula: C₁₃H₂F₂₂O₄
• Molecular Weight: 640.121
• DSSTox Substance ID: DTXSID90896530

Synonyms:1,3-Bis(3-oxaperfluoro-2-hexyl)-1,3-propanedione;1,1,1,2,6,7,7,7-OCTAFLUORO-2,6-BIS(HEPTAFLUOROPROPOXY)HEPTANE-3,5-DIONE;87405-74-1;SCHEMBL10319990;DTXSID90896530;UNLIPKHWLXWFAN-UHFFFAOYSA-N;1,1,1,2,6,7,7,7-octafluoro-2,6-bis(perfluoropropoxy)heptane-3,5-dione

Chemical Property of 1,3-Bis(3-oxaperfluoro-2-hexyl)-1,3-propanedione

Chemical Property:

• XLogP3: 7.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 26
• Rotatable Bond Count: 10
• Exact Mass: 639.9601781
• Heavy Atom Count: 39
• Complexity: 850

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Useful:

• Canonical SMILES: C(C(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)C(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F

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