8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene

C14H13F15 — CID 138396311

IUPAC8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene
SMILESCCCCCC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C14H13F15/c1-2-3-4-5-6-7-8(15,16)9(17,18)10(19,20)11(21,22)12(23,24)13(25,26)14(27,28)29/h6-7H,2-5H2,1H3
InChIKeyAEYWRUOLWSDNSX-UHFFFAOYSA-N
MW466.23 g/mol
LogP7.50
Rot. Bonds10

About 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene

8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene (PubChem CID 138396311) has the molecular formula C14H13F15 and a molecular weight of 466.23 g/mol. Its IUPAC name is 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene.

Molecular Properties

Compound Name8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene
PubChem CID138396311
Molecular FormulaC14H13F15
Molecular Weight466.23 g/mol
Exact Mass466.08
IUPAC Name8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene
SMILESCCCCCC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C14H13F15/c1-2-3-4-5-6-7-8(15,16)9(17,18)10(19,20)11(21,22)12(23,24)13(25,26)14(27,28)29/h6-7H,2-5H2,1H3
InChIKeyAEYWRUOLWSDNSX-UHFFFAOYSA-N
XLogP7.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.23
LogP ≤ 57.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene?
The IUPAC name of 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene (CID 138396311) is 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene.
What is the SMILES notation for 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene?
The canonical SMILES for 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene is CCCCCC=CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene?
The InChIKey is AEYWRUOLWSDNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F15/c1-2-3-4-5-6-7-8(15,16)9(17,18)10(19,20)11(21,22)12(23,24)13(25,26)14(27,28)29/h6-7H,2-5H2,1H3.
What are the key properties of 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene?
8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene has a molecular weight of 466.23 g/mol, XLogP of 7.50, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentadecafluorotetradec-6-ene is sourced from PubChem (CID 138396311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).