1,1,1,2,2,3,3,4-octafluorodec-4-ene

C10H12F8 — CID 71429346

IUPAC1,1,1,2,2,3,3,4-octafluorodec-4-ene
SMILESCCCCCC=C(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H12F8/c1-2-3-4-5-6-7(11)8(12,13)9(14,15)10(16,17)18/h6H,2-5H2,1H3
InChIKeyBWRNLAVMSIJMQH-UHFFFAOYSA-N
MW284.19 g/mol
LogP5.25
Rot. Bonds6

About 1,1,1,2,2,3,3,4-octafluorodec-4-ene

1,1,1,2,2,3,3,4-octafluorodec-4-ene (PubChem CID 71429346) has the molecular formula C10H12F8 and a molecular weight of 284.19 g/mol. Its IUPAC name is 1,1,1,2,2,3,3,4-octafluorodec-4-ene.

Molecular Properties

Compound Name1,1,1,2,2,3,3,4-octafluorodec-4-ene
PubChem CID71429346
Molecular FormulaC10H12F8
Molecular Weight284.19 g/mol
Exact Mass284.08
IUPAC Name1,1,1,2,2,3,3,4-octafluorodec-4-ene
SMILESCCCCCC=C(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H12F8/c1-2-3-4-5-6-7(11)8(12,13)9(14,15)10(16,17)18/h6H,2-5H2,1H3
InChIKeyBWRNLAVMSIJMQH-UHFFFAOYSA-N
XLogP5.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.19
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2,3,3,4-octafluorodec-4-ene?
The IUPAC name of 1,1,1,2,2,3,3,4-octafluorodec-4-ene (CID 71429346) is 1,1,1,2,2,3,3,4-octafluorodec-4-ene.
What is the SMILES notation for 1,1,1,2,2,3,3,4-octafluorodec-4-ene?
The canonical SMILES for 1,1,1,2,2,3,3,4-octafluorodec-4-ene is CCCCCC=C(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,2,3,3,4-octafluorodec-4-ene?
The InChIKey is BWRNLAVMSIJMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F8/c1-2-3-4-5-6-7(11)8(12,13)9(14,15)10(16,17)18/h6H,2-5H2,1H3.
What are the key properties of 1,1,1,2,2,3,3,4-octafluorodec-4-ene?
1,1,1,2,2,3,3,4-octafluorodec-4-ene has a molecular weight of 284.19 g/mol, XLogP of 5.25, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,2,3,3,4-octafluorodec-4-ene is sourced from PubChem (CID 71429346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).