2-dec-9-enoxyoxane

C15H28O2 — CID 11746754

IUPAC2-dec-9-enoxyoxane
SMILESC=CCCCCCCCCOC1CCCCO1
InChIInChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-10-13-16-15-12-9-11-14-17-15/h2,15H,1,3-14H2
InChIKeyUHHDVZVTDYIKML-UHFFFAOYSA-N
MW240.39 g/mol
LogP4.45
Rot. Bonds10

About 2-dec-9-enoxyoxane

2-dec-9-enoxyoxane (PubChem CID 11746754) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-dec-9-enoxyoxane.

Molecular Properties

Compound Name2-dec-9-enoxyoxane
PubChem CID11746754
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name2-dec-9-enoxyoxane
SMILESC=CCCCCCCCCOC1CCCCO1
InChIInChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-10-13-16-15-12-9-11-14-17-15/h2,15H,1,3-14H2
InChIKeyUHHDVZVTDYIKML-UHFFFAOYSA-N
XLogP4.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 54.45
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of 2-dec-9-enoxyoxane?
The IUPAC name of 2-dec-9-enoxyoxane (CID 11746754) is 2-dec-9-enoxyoxane.
What is the SMILES notation for 2-dec-9-enoxyoxane?
The canonical SMILES for 2-dec-9-enoxyoxane is C=CCCCCCCCCOC1CCCCO1.
What is the InChIKey of 2-dec-9-enoxyoxane?
The InChIKey is UHHDVZVTDYIKML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-10-13-16-15-12-9-11-14-17-15/h2,15H,1,3-14H2.
What are the key properties of 2-dec-9-enoxyoxane?
2-dec-9-enoxyoxane has a molecular weight of 240.39 g/mol, XLogP of 4.45, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dec-9-enoxyoxane is sourced from PubChem (CID 11746754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).