5-(ethenoxymethyl)undecane

C14H28O — CID 90318537

IUPAC5-(ethenoxymethyl)undecane
SMILESC=COCC(CCCC)CCCCCC
InChIInChI=1S/C14H28O/c1-4-7-9-10-12-14(11-8-5-2)13-15-6-3/h6,14H,3-5,7-13H2,1-2H3
InChIKeyFOCKUDQEGIKXJM-UHFFFAOYSA-N
MW212.38 g/mol
LogP4.92
Rot. Bonds11

About 5-(ethenoxymethyl)undecane

5-(ethenoxymethyl)undecane (PubChem CID 90318537) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is 5-(ethenoxymethyl)undecane.

Molecular Properties

Compound Name5-(ethenoxymethyl)undecane
PubChem CID90318537
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Name5-(ethenoxymethyl)undecane
SMILESC=COCC(CCCC)CCCCCC
InChIInChI=1S/C14H28O/c1-4-7-9-10-12-14(11-8-5-2)13-15-6-3/h6,14H,3-5,7-13H2,1-2H3
InChIKeyFOCKUDQEGIKXJM-UHFFFAOYSA-N
XLogP4.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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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Related Compounds

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13-butyldotriacontane
CID 91613083
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Frequently Asked Questions

What is the IUPAC name of 5-(ethenoxymethyl)undecane?
The IUPAC name of 5-(ethenoxymethyl)undecane (CID 90318537) is 5-(ethenoxymethyl)undecane.
What is the SMILES notation for 5-(ethenoxymethyl)undecane?
The canonical SMILES for 5-(ethenoxymethyl)undecane is C=COCC(CCCC)CCCCCC.
What is the InChIKey of 5-(ethenoxymethyl)undecane?
The InChIKey is FOCKUDQEGIKXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O/c1-4-7-9-10-12-14(11-8-5-2)13-15-6-3/h6,14H,3-5,7-13H2,1-2H3.
What are the key properties of 5-(ethenoxymethyl)undecane?
5-(ethenoxymethyl)undecane has a molecular weight of 212.38 g/mol, XLogP of 4.92, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethenoxymethyl)undecane is sourced from PubChem (CID 90318537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).