2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane

C15H28O2 — CID 134979706

IUPAC2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane
SMILESCC(C)=CCCC(C)CCCCC1OCCO1
InChIInChI=1S/C15H28O2/c1-13(2)7-6-9-14(3)8-4-5-10-15-16-11-12-17-15/h7,14-15H,4-6,8-12H2,1-3H3
InChIKeyOHGISPKTSLAKFN-UHFFFAOYSA-N
MW240.39 g/mol
LogP4.30
Rot. Bonds8

About 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane

2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane (PubChem CID 134979706) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane
PubChem CID134979706
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane
SMILESCC(C)=CCCC(C)CCCCC1OCCO1
InChIInChI=1S/C15H28O2/c1-13(2)7-6-9-14(3)8-4-5-10-15-16-11-12-17-15/h7,14-15H,4-6,8-12H2,1-3H3
InChIKeyOHGISPKTSLAKFN-UHFFFAOYSA-N
XLogP4.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 54.30
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'}

Analyze 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane?
The IUPAC name of 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane (CID 134979706) is 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane.
What is the SMILES notation for 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane?
The canonical SMILES for 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane is CC(C)=CCCC(C)CCCCC1OCCO1.
What is the InChIKey of 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane?
The InChIKey is OHGISPKTSLAKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-13(2)7-6-9-14(3)8-4-5-10-15-16-11-12-17-15/h7,14-15H,4-6,8-12H2,1-3H3.
What are the key properties of 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane?
2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane has a molecular weight of 240.39 g/mol, XLogP of 4.30, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,9-dimethyldec-8-enyl)-1,3-dioxolane is sourced from PubChem (CID 134979706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).