1,1,6,6-tetrafluorohexa-1,5-diene

C6H6F4 — CID 12965533

IUPAC1,1,6,6-tetrafluorohexa-1,5-diene
SMILESFC(F)=CCCC=C(F)F
InChIInChI=1S/C6H6F4/c7-5(8)3-1-2-4-6(9)10/h3-4H,1-2H2
InChIKeyFHTGAWCERWTDDS-UHFFFAOYSA-N
MW154.11 g/mol
LogP3.33
Rot. Bonds3

About 1,1,6,6-tetrafluorohexa-1,5-diene

1,1,6,6-tetrafluorohexa-1,5-diene (PubChem CID 12965533) has the molecular formula C6H6F4 and a molecular weight of 154.11 g/mol. Its IUPAC name is 1,1,6,6-tetrafluorohexa-1,5-diene.

Molecular Properties

Compound Name1,1,6,6-tetrafluorohexa-1,5-diene
PubChem CID12965533
Molecular FormulaC6H6F4
Molecular Weight154.11 g/mol
Exact Mass154.04
IUPAC Name1,1,6,6-tetrafluorohexa-1,5-diene
SMILESFC(F)=CCCC=C(F)F
InChIInChI=1S/C6H6F4/c7-5(8)3-1-2-4-6(9)10/h3-4H,1-2H2
InChIKeyFHTGAWCERWTDDS-UHFFFAOYSA-N
XLogP3.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.11
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3,3,4,4,5,5-Heptafluoro-1-pentene
CID 13750142
3,3,4,4,5,5,6,6,6-Nonafluoro-1-hexene
CID 88054
3,3,4,4,4-Pentafluorobut-1-ene
CID 78990
3,3,4,4,5,5,5-Heptafluoropent-1-ene
CID 67727
4,4,5,5,6,6,7,7,7-Nonafluorohepta-1,2-diene
CID 14816571
3,3,4,4,5,5,6,6-Octafluoro-1-hexene
CID 15828066
1H-Perfluorohex-1-ene
CID 21455498
1,1,3,4,4,4-Hexafluoro-3-(trifluoromethyl)but-1-ene
CID 54420071
Ethene;3,3,4,4,5,5,6,6,6-nonafluorohex-1-ene;1,1,2,2-tetrafluoroethene
CID 176369
(1Z)-1,2,3,3,4,4,5,5,6,6,6-Undecafluorohex-1-ene
CID 14922985
(1E)-1,2,3,3,4,4,5,5,6,6,6-Undecafluorohex-1-ene
CID 71669145
1,1-Difluorobut-1-ene
CID 2782310

Frequently Asked Questions

What is the IUPAC name of 1,1,6,6-tetrafluorohexa-1,5-diene?
The IUPAC name of 1,1,6,6-tetrafluorohexa-1,5-diene (CID 12965533) is 1,1,6,6-tetrafluorohexa-1,5-diene.
What is the SMILES notation for 1,1,6,6-tetrafluorohexa-1,5-diene?
The canonical SMILES for 1,1,6,6-tetrafluorohexa-1,5-diene is FC(F)=CCCC=C(F)F.
What is the InChIKey of 1,1,6,6-tetrafluorohexa-1,5-diene?
The InChIKey is FHTGAWCERWTDDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F4/c7-5(8)3-1-2-4-6(9)10/h3-4H,1-2H2.
What are the key properties of 1,1,6,6-tetrafluorohexa-1,5-diene?
1,1,6,6-tetrafluorohexa-1,5-diene has a molecular weight of 154.11 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,6,6-tetrafluorohexa-1,5-diene is sourced from PubChem (CID 12965533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).