(E)-11,11,11-trifluoroundec-8-en-1-ol

C11H19F3O — CID 90276508

IUPAC(E)-11,11,11-trifluoroundec-8-en-1-ol
SMILESOCCCCCCC/C=C/CC(F)(F)F
InChIInChI=1S/C11H19F3O/c12-11(13,14)9-7-5-3-1-2-4-6-8-10-15/h5,7,15H,1-4,6,8-10H2/b7-5+
InChIKeyWIXFGOXCADBQJL-FNORWQNLSA-N
MW224.27 g/mol
LogP3.83
Rot. Bonds8

About (E)-11,11,11-trifluoroundec-8-en-1-ol

(E)-11,11,11-trifluoroundec-8-en-1-ol (PubChem CID 90276508) has the molecular formula C11H19F3O and a molecular weight of 224.27 g/mol. Its IUPAC name is (E)-11,11,11-trifluoroundec-8-en-1-ol.

Molecular Properties

Compound Name(E)-11,11,11-trifluoroundec-8-en-1-ol
PubChem CID90276508
Molecular FormulaC11H19F3O
Molecular Weight224.27 g/mol
Exact Mass224.14
IUPAC Name(E)-11,11,11-trifluoroundec-8-en-1-ol
SMILESOCCCCCCC/C=C/CC(F)(F)F
InChIInChI=1S/C11H19F3O/c12-11(13,14)9-7-5-3-1-2-4-6-8-10-15/h5,7,15H,1-4,6,8-10H2/b7-5+
InChIKeyWIXFGOXCADBQJL-FNORWQNLSA-N
XLogP3.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Myristoleyl alcohol
CID 5364712
8-Dodecen-1-ol, (8Z)-
CID 5283295
Cis-11-tetradecenol
CID 1712010
(Z)-dodec-7-enol
CID 5362794
9-Dodecen-1-ol, (9E)-
CID 5283277
11-Tetradecen-1-ol, (11E)-
CID 1712011
(9E)-9-Tetradecen-1-ol
CID 5352284
9-Dodecen-1-ol, (9Z)-
CID 6431342
cis-7-Tetradecenol
CID 5362795
9-Dodecen-1-ol
CID 93181
9,12-Tetradecadien-1-ol, (9E,12Z)-
CID 6436736
(Z)-8-Tetradecen-1-ol
CID 6431341

Frequently Asked Questions

What is the IUPAC name of (E)-11,11,11-trifluoroundec-8-en-1-ol?
The IUPAC name of (E)-11,11,11-trifluoroundec-8-en-1-ol (CID 90276508) is (E)-11,11,11-trifluoroundec-8-en-1-ol.
What is the SMILES notation for (E)-11,11,11-trifluoroundec-8-en-1-ol?
The canonical SMILES for (E)-11,11,11-trifluoroundec-8-en-1-ol is OCCCCCCC/C=C/CC(F)(F)F.
What is the InChIKey of (E)-11,11,11-trifluoroundec-8-en-1-ol?
The InChIKey is WIXFGOXCADBQJL-FNORWQNLSA-N. The full InChI is InChI=1S/C11H19F3O/c12-11(13,14)9-7-5-3-1-2-4-6-8-10-15/h5,7,15H,1-4,6,8-10H2/b7-5+.
What are the key properties of (E)-11,11,11-trifluoroundec-8-en-1-ol?
(E)-11,11,11-trifluoroundec-8-en-1-ol has a molecular weight of 224.27 g/mol, XLogP of 3.83, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-11,11,11-trifluoroundec-8-en-1-ol is sourced from PubChem (CID 90276508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).