2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane

C11H18O2 — CID 125476243

IUPAC2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane
SMILESC(=C/C1OCCO1)\C1CCCCC1
InChIInChI=1S/C11H18O2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h6-7,10-11H,1-5,8-9H2/b7-6+
InChIKeySHHFVKJKZHJKLT-VOTSOKGWSA-N
MW182.26 g/mol
LogP2.50
Rot. Bonds2

About 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane

2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane (PubChem CID 125476243) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane.

Molecular Properties

Compound Name2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane
PubChem CID125476243
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane
SMILESC(=C/C1OCCO1)\C1CCCCC1
InChIInChI=1S/C11H18O2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h6-7,10-11H,1-5,8-9H2/b7-6+
InChIKeySHHFVKJKZHJKLT-VOTSOKGWSA-N
XLogP2.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Methyl-2-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethenyl]-1,3-dioxolane
CID 70371688
2-methyl-2-[(E)-2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethenyl]-1,3-dioxolane
CID 58005039
1,3-Dioxolane, 2-(3-cyclohexen-1-yl)-4-[(2-propenyloxy)methyl]-
CID 247391
4-[(E)-2-cyclohexylethenyl]-2,2-dimethyl-1,3-dioxolane
CID 13440554
2-[(1E)-3,7-dimethylocta-1,6-dienyl]-1,3-dioxolane
CID 24881903
2-[(E)-3-cyclohexylprop-2-enyl]-1,3-dioxolane
CID 135032763
2-[(E)-2-(4-butylcyclohexyl)ethenyl]-1,3-dioxolane
CID 23317164
trans-4-Butyl-1-[2-(1,3-dioxolan-2-yl)-vinyl]cyclohexane
CID 53977572
2-[(E)-oct-1-enyl]-1,3-dioxolane
CID 55255256
2-(1-Cyclohexylidenepent-4-enyl)-1,3-dioxolane
CID 69515433
2-[(E)-2,6-dimethylhept-1-enyl]-1,3-dioxolane
CID 89208750
2-(4,6-Dimethylhept-1-enyl)-1,3-dioxolane
CID 91110897

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane?
The IUPAC name of 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane (CID 125476243) is 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane.
What is the SMILES notation for 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane?
The canonical SMILES for 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane is C(=C/C1OCCO1)\C1CCCCC1.
What is the InChIKey of 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane?
The InChIKey is SHHFVKJKZHJKLT-VOTSOKGWSA-N. The full InChI is InChI=1S/C11H18O2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h6-7,10-11H,1-5,8-9H2/b7-6+.
What are the key properties of 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane?
2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane has a molecular weight of 182.26 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-cyclohexylethenyl]-1,3-dioxolane is sourced from PubChem (CID 125476243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).