(4E,7Z)-5-fluoroundeca-4,7-dien-6-ol

C11H19FO — CID 58305104

IUPAC(4E,7Z)-5-fluoroundeca-4,7-dien-6-ol
SMILESCCC/C=C\C(O)/C(F)=C\CCC
InChIInChI=1S/C11H19FO/c1-3-5-7-9-11(13)10(12)8-6-4-2/h7-9,11,13H,3-6H2,1-2H3/b9-7-,10-8+
InChIKeyWHLWKJWKWAOBSE-FKJILZIQSA-N
MW186.27 g/mol
LogP3.36
Rot. Bonds6

About (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol

(4E,7Z)-5-fluoroundeca-4,7-dien-6-ol (PubChem CID 58305104) has the molecular formula C11H19FO and a molecular weight of 186.27 g/mol. Its IUPAC name is (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol.

Molecular Properties

Compound Name(4E,7Z)-5-fluoroundeca-4,7-dien-6-ol
PubChem CID58305104
Molecular FormulaC11H19FO
Molecular Weight186.27 g/mol
Exact Mass186.14
IUPAC Name(4E,7Z)-5-fluoroundeca-4,7-dien-6-ol
SMILESCCC/C=C\C(O)/C(F)=C\CCC
InChIInChI=1S/C11H19FO/c1-3-5-7-9-11(13)10(12)8-6-4-2/h7-9,11,13H,3-6H2,1-2H3/b9-7-,10-8+
InChIKeyWHLWKJWKWAOBSE-FKJILZIQSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol?
The IUPAC name of (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol (CID 58305104) is (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol.
What is the SMILES notation for (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol?
The canonical SMILES for (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol is CCC/C=C\C(O)/C(F)=C\CCC.
What is the InChIKey of (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol?
The InChIKey is WHLWKJWKWAOBSE-FKJILZIQSA-N. The full InChI is InChI=1S/C11H19FO/c1-3-5-7-9-11(13)10(12)8-6-4-2/h7-9,11,13H,3-6H2,1-2H3/b9-7-,10-8+.
What are the key properties of (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol?
(4E,7Z)-5-fluoroundeca-4,7-dien-6-ol has a molecular weight of 186.27 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,7Z)-5-fluoroundeca-4,7-dien-6-ol is sourced from PubChem (CID 58305104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).