2-ethyl-4-non-8-enyloxolane

C15H28O — CID 86109328

IUPAC2-ethyl-4-non-8-enyloxolane
SMILESC=CCCCCCCCC1COC(CC)C1
InChIInChI=1S/C15H28O/c1-3-5-6-7-8-9-10-11-14-12-15(4-2)16-13-14/h3,14-15H,1,4-13H2,2H3
InChIKeyLWUZMWAZAMHQAQ-UHFFFAOYSA-N
MW224.39 g/mol
LogP4.72
Rot. Bonds9

About 2-ethyl-4-non-8-enyloxolane

2-ethyl-4-non-8-enyloxolane (PubChem CID 86109328) has the molecular formula C15H28O and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-ethyl-4-non-8-enyloxolane.

Molecular Properties

Compound Name2-ethyl-4-non-8-enyloxolane
PubChem CID86109328
Molecular FormulaC15H28O
Molecular Weight224.39 g/mol
Exact Mass224.21
IUPAC Name2-ethyl-4-non-8-enyloxolane
SMILESC=CCCCCCCCC1COC(CC)C1
InChIInChI=1S/C15H28O/c1-3-5-6-7-8-9-10-11-14-12-15(4-2)16-13-14/h3,14-15H,1,4-13H2,2H3
InChIKeyLWUZMWAZAMHQAQ-UHFFFAOYSA-N
XLogP4.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 54.72
H-Bond Donors ≤ 50
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 2-ethyl-4-non-8-enyloxolane?
The IUPAC name of 2-ethyl-4-non-8-enyloxolane (CID 86109328) is 2-ethyl-4-non-8-enyloxolane.
What is the SMILES notation for 2-ethyl-4-non-8-enyloxolane?
The canonical SMILES for 2-ethyl-4-non-8-enyloxolane is C=CCCCCCCCC1COC(CC)C1.
What is the InChIKey of 2-ethyl-4-non-8-enyloxolane?
The InChIKey is LWUZMWAZAMHQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O/c1-3-5-6-7-8-9-10-11-14-12-15(4-2)16-13-14/h3,14-15H,1,4-13H2,2H3.
What are the key properties of 2-ethyl-4-non-8-enyloxolane?
2-ethyl-4-non-8-enyloxolane has a molecular weight of 224.39 g/mol, XLogP of 4.72, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-non-8-enyloxolane is sourced from PubChem (CID 86109328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).