(E)-9-ethenylundec-5-ene-1,11-diol

C13H24O2 — CID 23591510

IUPAC(E)-9-ethenylundec-5-ene-1,11-diol
SMILESC=CC(CCO)CC/C=C/CCCCO
InChIInChI=1S/C13H24O2/c1-2-13(10-12-15)9-7-5-3-4-6-8-11-14/h2-3,5,13-15H,1,4,6-12H2/b5-3+
InChIKeyQACUCUYGNZFWFO-HWKANZROSA-N
MW212.33 g/mol
LogP2.67
Rot. Bonds10

About (E)-9-ethenylundec-5-ene-1,11-diol

(E)-9-ethenylundec-5-ene-1,11-diol (PubChem CID 23591510) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is (E)-9-ethenylundec-5-ene-1,11-diol.

Molecular Properties

Compound Name(E)-9-ethenylundec-5-ene-1,11-diol
PubChem CID23591510
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name(E)-9-ethenylundec-5-ene-1,11-diol
SMILESC=CC(CCO)CC/C=C/CCCCO
InChIInChI=1S/C13H24O2/c1-2-13(10-12-15)9-7-5-3-4-6-8-11-14/h2-3,5,13-15H,1,4,6-12H2/b5-3+
InChIKeyQACUCUYGNZFWFO-HWKANZROSA-N
XLogP2.67
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

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(2R)-2-ethenylhexane-1,6-diol
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sodium;(E)-hept-1-ene-1,7-diol;hydride
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(E)-9-ethenyl-N,N-dimethyldodec-5-en-1-amine
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(2E,8Z)-5-ethenyldeca-2,8-diene-1,10-diol;methane
CID 160519828
(E)-hexadec-1-ene-1,16-diol
CID 57427575
heptadec-1-ene-1,17-diol
CID 142730253
(Z)-18-hydroxyoctadec-9-enal
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heptadeca-14,16-dien-1-ol
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deca-7,9-dien-1-ol
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Frequently Asked Questions

What is the IUPAC name of (E)-9-ethenylundec-5-ene-1,11-diol?
The IUPAC name of (E)-9-ethenylundec-5-ene-1,11-diol (CID 23591510) is (E)-9-ethenylundec-5-ene-1,11-diol.
What is the SMILES notation for (E)-9-ethenylundec-5-ene-1,11-diol?
The canonical SMILES for (E)-9-ethenylundec-5-ene-1,11-diol is C=CC(CCO)CC/C=C/CCCCO.
What is the InChIKey of (E)-9-ethenylundec-5-ene-1,11-diol?
The InChIKey is QACUCUYGNZFWFO-HWKANZROSA-N. The full InChI is InChI=1S/C13H24O2/c1-2-13(10-12-15)9-7-5-3-4-6-8-11-14/h2-3,5,13-15H,1,4,6-12H2/b5-3+.
What are the key properties of (E)-9-ethenylundec-5-ene-1,11-diol?
(E)-9-ethenylundec-5-ene-1,11-diol has a molecular weight of 212.33 g/mol, XLogP of 2.67, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-9-ethenylundec-5-ene-1,11-diol is sourced from PubChem (CID 23591510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).