1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene

C6F10 — CID 143759178

IUPAC1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene
SMILESFC(=C=C(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6F10/c7-2(1-3(8)5(11,12)13)4(9,10)6(14,15)16
InChIKeyUXOILMYNRJGLDI-UHFFFAOYSA-N
MW262.05 g/mol
LogP4.05
Rot. Bonds1

About 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene

1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene (PubChem CID 143759178) has the molecular formula C6F10 and a molecular weight of 262.05 g/mol. Its IUPAC name is 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene.

Molecular Properties

Compound Name1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene
PubChem CID143759178
Molecular FormulaC6F10
Molecular Weight262.05 g/mol
Exact Mass261.98
IUPAC Name1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene
SMILESFC(=C=C(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6F10/c7-2(1-3(8)5(11,12)13)4(9,10)6(14,15)16
InChIKeyUXOILMYNRJGLDI-UHFFFAOYSA-N
XLogP4.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.05
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene?
The IUPAC name of 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene (CID 143759178) is 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene.
What is the SMILES notation for 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene?
The canonical SMILES for 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene is FC(=C=C(F)C(F)(F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene?
The InChIKey is UXOILMYNRJGLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F10/c7-2(1-3(8)5(11,12)13)4(9,10)6(14,15)16.
What are the key properties of 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene?
1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene has a molecular weight of 262.05 g/mol, XLogP of 4.05, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,4,5,5,6,6,6-decafluorohexa-2,3-diene is sourced from PubChem (CID 143759178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).