11-ethenoxy-2-fluoroundecan-1-ol

C13H25FO2 — CID 139609456

IUPAC11-ethenoxy-2-fluoroundecan-1-ol
SMILESC=COCCCCCCCCCC(F)CO
InChIInChI=1S/C13H25FO2/c1-2-16-11-9-7-5-3-4-6-8-10-13(14)12-15/h2,13,15H,1,3-12H2
InChIKeyWOPOQSLKHAQMAI-UHFFFAOYSA-N
MW232.34 g/mol
LogP3.60
Rot. Bonds12

About 11-ethenoxy-2-fluoroundecan-1-ol

11-ethenoxy-2-fluoroundecan-1-ol (PubChem CID 139609456) has the molecular formula C13H25FO2 and a molecular weight of 232.34 g/mol. Its IUPAC name is 11-ethenoxy-2-fluoroundecan-1-ol.

Molecular Properties

Compound Name11-ethenoxy-2-fluoroundecan-1-ol
PubChem CID139609456
Molecular FormulaC13H25FO2
Molecular Weight232.34 g/mol
Exact Mass232.18
IUPAC Name11-ethenoxy-2-fluoroundecan-1-ol
SMILESC=COCCCCCCCCCC(F)CO
InChIInChI=1S/C13H25FO2/c1-2-16-11-9-7-5-3-4-6-8-10-13(14)12-15/h2,13,15H,1,3-12H2
InChIKeyWOPOQSLKHAQMAI-UHFFFAOYSA-N
XLogP3.60
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.34
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 11-ethenoxy-2-fluoroundecan-1-ol?
The IUPAC name of 11-ethenoxy-2-fluoroundecan-1-ol (CID 139609456) is 11-ethenoxy-2-fluoroundecan-1-ol.
What is the SMILES notation for 11-ethenoxy-2-fluoroundecan-1-ol?
The canonical SMILES for 11-ethenoxy-2-fluoroundecan-1-ol is C=COCCCCCCCCCC(F)CO.
What is the InChIKey of 11-ethenoxy-2-fluoroundecan-1-ol?
The InChIKey is WOPOQSLKHAQMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25FO2/c1-2-16-11-9-7-5-3-4-6-8-10-13(14)12-15/h2,13,15H,1,3-12H2.
What are the key properties of 11-ethenoxy-2-fluoroundecan-1-ol?
11-ethenoxy-2-fluoroundecan-1-ol has a molecular weight of 232.34 g/mol, XLogP of 3.60, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethenoxy-2-fluoroundecan-1-ol is sourced from PubChem (CID 139609456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).