(4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol

C18H28O — CID 73441687

IUPAC(4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol
SMILESCC(/C=C/C1CCCCC1)=C\C=C\C=C\CCCO
InChIInChI=1S/C18H28O/c1-17(11-7-4-2-3-5-10-16-19)14-15-18-12-8-6-9-13-18/h2-4,7,11,14-15,18-19H,5-6,8-10,12-13,16H2,1H3/b3-2+,7-4+,15-14+,17-11+
InChIKeyQHWIEFCWDUVURO-QKZMJOMASA-N
MW260.42 g/mol
LogP4.95
Rot. Bonds7

About (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol

(4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol (PubChem CID 73441687) has the molecular formula C18H28O and a molecular weight of 260.42 g/mol. Its IUPAC name is (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol.

Molecular Properties

Compound Name(4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol
PubChem CID73441687
Molecular FormulaC18H28O
Molecular Weight260.42 g/mol
Exact Mass260.21
IUPAC Name(4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol
SMILESCC(/C=C/C1CCCCC1)=C\C=C\C=C\CCCO
InChIInChI=1S/C18H28O/c1-17(11-7-4-2-3-5-10-16-19)14-15-18-12-8-6-9-13-18/h2-4,7,11,14-15,18-19H,5-6,8-10,12-13,16H2,1H3/b3-2+,7-4+,15-14+,17-11+
InChIKeyQHWIEFCWDUVURO-QKZMJOMASA-N
XLogP4.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol?
The IUPAC name of (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol (CID 73441687) is (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol.
What is the SMILES notation for (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol?
The canonical SMILES for (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol is CC(/C=C/C1CCCCC1)=C\C=C\C=C\CCCO.
What is the InChIKey of (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol?
The InChIKey is QHWIEFCWDUVURO-QKZMJOMASA-N. The full InChI is InChI=1S/C18H28O/c1-17(11-7-4-2-3-5-10-16-19)14-15-18-12-8-6-9-13-18/h2-4,7,11,14-15,18-19H,5-6,8-10,12-13,16H2,1H3/b3-2+,7-4+,15-14+,17-11+.
What are the key properties of (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol?
(4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol has a molecular weight of 260.42 g/mol, XLogP of 4.95, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,6E,8E,10E)-11-cyclohexyl-9-methylundeca-4,6,8,10-tetraen-1-ol is sourced from PubChem (CID 73441687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).