1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene

C8F14 — CID 12808571

IUPAC1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene
SMILESFC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)=C(F)F
InChIInChI=1S/C8F14/c9-1(3(11)12)5(15,16)7(19,20)8(21,22)6(17,18)2(10)4(13)14
InChIKeyAEGUVNHLYAZFAU-UHFFFAOYSA-N
MW362.06 g/mol
LogP5.68
Rot. Bonds5

About 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene

1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene (PubChem CID 12808571) has the molecular formula C8F14 and a molecular weight of 362.06 g/mol. Its IUPAC name is 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene.

Molecular Properties

Compound Name1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene
PubChem CID12808571
Molecular FormulaC8F14
Molecular Weight362.06 g/mol
Exact Mass361.98
IUPAC Name1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene
SMILESFC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)=C(F)F
InChIInChI=1S/C8F14/c9-1(3(11)12)5(15,16)7(19,20)8(21,22)6(17,18)2(10)4(13)14
InChIKeyAEGUVNHLYAZFAU-UHFFFAOYSA-N
XLogP5.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.06
LogP ≤ 55.68
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 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene?
The IUPAC name of 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene (CID 12808571) is 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene.
What is the SMILES notation for 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene?
The canonical SMILES for 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene is FC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)=C(F)F.
What is the InChIKey of 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene?
The InChIKey is AEGUVNHLYAZFAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F14/c9-1(3(11)12)5(15,16)7(19,20)8(21,22)6(17,18)2(10)4(13)14.
What are the key properties of 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene?
1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene has a molecular weight of 362.06 g/mol, XLogP of 5.68, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3,4,4,5,5,6,6,7,8,8-tetradecafluoroocta-1,7-diene is sourced from PubChem (CID 12808571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).