(E)-14-methylhexadec-8-en-1-ol

C17H34O — CID 5283286

IUPAC(E)-14-methylhexadec-8-en-1-ol
SMILESCCC(C)CCCC/C=C/CCCCCCCO
InChIInChI=1S/C17H34O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h5,7,17-18H,3-4,6,8-16H2,1-2H3/b7-5+
InChIKeyQRFJDYPDABYWFH-FNORWQNLSA-N
MW254.46 g/mol
LogP5.48
Rot. Bonds13

About (E)-14-methylhexadec-8-en-1-ol

(E)-14-methylhexadec-8-en-1-ol (PubChem CID 5283286) has the molecular formula C17H34O and a molecular weight of 254.46 g/mol. Its IUPAC name is (E)-14-methylhexadec-8-en-1-ol.

Molecular Properties

Compound Name(E)-14-methylhexadec-8-en-1-ol
PubChem CID5283286
Molecular FormulaC17H34O
Molecular Weight254.46 g/mol
Exact Mass254.26
IUPAC Name(E)-14-methylhexadec-8-en-1-ol
SMILESCCC(C)CCCC/C=C/CCCCCCCO
InChIInChI=1S/C17H34O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h5,7,17-18H,3-4,6,8-16H2,1-2H3/b7-5+
InChIKeyQRFJDYPDABYWFH-FNORWQNLSA-N
XLogP5.48
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.46
LogP ≤ 55.48
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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Frequently Asked Questions

What is the IUPAC name of (E)-14-methylhexadec-8-en-1-ol?
The IUPAC name of (E)-14-methylhexadec-8-en-1-ol (CID 5283286) is (E)-14-methylhexadec-8-en-1-ol.
What is the SMILES notation for (E)-14-methylhexadec-8-en-1-ol?
The canonical SMILES for (E)-14-methylhexadec-8-en-1-ol is CCC(C)CCCC/C=C/CCCCCCCO.
What is the InChIKey of (E)-14-methylhexadec-8-en-1-ol?
The InChIKey is QRFJDYPDABYWFH-FNORWQNLSA-N. The full InChI is InChI=1S/C17H34O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h5,7,17-18H,3-4,6,8-16H2,1-2H3/b7-5+.
What are the key properties of (E)-14-methylhexadec-8-en-1-ol?
(E)-14-methylhexadec-8-en-1-ol has a molecular weight of 254.46 g/mol, XLogP of 5.48, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-14-methylhexadec-8-en-1-ol is sourced from PubChem (CID 5283286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).