2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane

C14H24O2 — CID 91750486

IUPAC2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane
SMILESCC(C)=CCC/C(C)=C\CC1OCC(C)O1
InChIInChI=1S/C14H24O2/c1-11(2)6-5-7-12(3)8-9-14-15-10-13(4)16-14/h6,8,13-14H,5,7,9-10H2,1-4H3/b12-8-
InChIKeySOLUPKFWUPOIEI-WQLSENKSSA-N
MW224.34 g/mol
LogP3.83
Rot. Bonds5

About 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane

2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane (PubChem CID 91750486) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane.

Molecular Properties

Compound Name2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane
PubChem CID91750486
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane
SMILESCC(C)=CCC/C(C)=C\CC1OCC(C)O1
InChIInChI=1S/C14H24O2/c1-11(2)6-5-7-12(3)8-9-14-15-10-13(4)16-14/h6,8,13-14H,5,7,9-10H2,1-4H3/b12-8-
InChIKeySOLUPKFWUPOIEI-WQLSENKSSA-N
XLogP3.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-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

Related Compounds

Geranial propylene glycol acetal
CID 5338463
Citracetal
CID 1615097
2,4-Dimethyl-2-(4-methylpent-3-enyl)-1,3-dioxolane
CID 109257
2,6-Dimethyl-5-heptenal propylene glycol acetal
CID 44153717
1,3-Dioxolane, 2-(2,6-dimethyl-1,5-heptadienyl)-4-methyl-
CID 61519
2-Methyl-2-(4-methylpent-3-enyl)-1,3-dioxolane
CID 77280
2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane
CID 47922
1,3-Dioxolane, 2-(2,6-dimethyl-1,5-heptadien-1-yl)-4,5-dimethyl-
CID 5980986
2-methyl-2-[(E)-4-methylnon-3-enyl]-1,3-dioxolane
CID 12541153
2-methyl-2-[(E)-4-methylhex-3-enyl]-1,3-dioxolane
CID 12541151
2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methyl-1,3-dioxolane
CID 24859456
2-[(1Z)-2,6-dimethylhepta-1,5-dienyl]-4,5-dimethyl-1,3-dioxolane
CID 5356479

Frequently Asked Questions

What is the IUPAC name of 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane?
The IUPAC name of 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane (CID 91750486) is 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane.
What is the SMILES notation for 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane?
The canonical SMILES for 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane is CC(C)=CCC/C(C)=C\CC1OCC(C)O1.
What is the InChIKey of 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane?
The InChIKey is SOLUPKFWUPOIEI-WQLSENKSSA-N. The full InChI is InChI=1S/C14H24O2/c1-11(2)6-5-7-12(3)8-9-14-15-10-13(4)16-14/h6,8,13-14H,5,7,9-10H2,1-4H3/b12-8-.
What are the key properties of 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane?
2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane has a molecular weight of 224.34 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z)-3,7-dimethylocta-2,6-dienyl]-4-methyl-1,3-dioxolane is sourced from PubChem (CID 91750486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).