1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene

C6F10 — CID 88689237

IUPAC1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene
SMILESFC(F)=C(F)C(F)(C(F)=C(F)F)C(F)(F)F
InChIInChI=1S/C6F10/c7-1(3(9)10)5(13,6(14,15)16)2(8)4(11)12
InChIKeyDLCWOADOXJGXHY-UHFFFAOYSA-N
MW262.05 g/mol
LogP4.41
Rot. Bonds2

About 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene

1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene (PubChem CID 88689237) has the molecular formula C6F10 and a molecular weight of 262.05 g/mol. Its IUPAC name is 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene.

Molecular Properties

Compound Name1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene
PubChem CID88689237
Molecular FormulaC6F10
Molecular Weight262.05 g/mol
Exact Mass261.98
IUPAC Name1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene
SMILESFC(F)=C(F)C(F)(C(F)=C(F)F)C(F)(F)F
InChIInChI=1S/C6F10/c7-1(3(9)10)5(13,6(14,15)16)2(8)4(11)12
InChIKeyDLCWOADOXJGXHY-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.05
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene?
The IUPAC name of 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene (CID 88689237) is 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene.
What is the SMILES notation for 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene?
The canonical SMILES for 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene is FC(F)=C(F)C(F)(C(F)=C(F)F)C(F)(F)F.
What is the InChIKey of 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene?
The InChIKey is DLCWOADOXJGXHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F10/c7-1(3(9)10)5(13,6(14,15)16)2(8)4(11)12.
What are the key properties of 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene?
1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene has a molecular weight of 262.05 g/mol, XLogP of 4.41, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,4,5,5-heptafluoro-3-(trifluoromethyl)penta-1,4-diene is sourced from PubChem (CID 88689237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).