3-(ethenoxymethyl)-3-methyloxolane

C8H14O2 — CID 176603173

IUPAC3-(ethenoxymethyl)-3-methyloxolane
SMILESC=COCC1(C)CCOC1
InChIInChI=1S/C8H14O2/c1-3-9-6-8(2)4-5-10-7-8/h3H,1,4-7H2,2H3
InChIKeyCUDCVHZLWYCGLB-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.57
Rot. Bonds3

About 3-(ethenoxymethyl)-3-methyloxolane

3-(ethenoxymethyl)-3-methyloxolane (PubChem CID 176603173) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-(ethenoxymethyl)-3-methyloxolane.

Molecular Properties

Compound Name3-(ethenoxymethyl)-3-methyloxolane
PubChem CID176603173
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name3-(ethenoxymethyl)-3-methyloxolane
SMILESC=COCC1(C)CCOC1
InChIInChI=1S/C8H14O2/c1-3-9-6-8(2)4-5-10-7-8/h3H,1,4-7H2,2H3
InChIKeyCUDCVHZLWYCGLB-UHFFFAOYSA-N
XLogP1.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

1,4-Bis(ethenoxy)-2-(ethenoxymethyl)-2-methylbutane
CID 87770238
3-methyl-3-[[(E)-prop-1-enoxy]methyl]oxolane
CID 176603529
3-(Ethenoxymethyl)-3-ethyloxolane
CID 176605176

Frequently Asked Questions

What is the IUPAC name of 3-(ethenoxymethyl)-3-methyloxolane?
The IUPAC name of 3-(ethenoxymethyl)-3-methyloxolane (CID 176603173) is 3-(ethenoxymethyl)-3-methyloxolane.
What is the SMILES notation for 3-(ethenoxymethyl)-3-methyloxolane?
The canonical SMILES for 3-(ethenoxymethyl)-3-methyloxolane is C=COCC1(C)CCOC1.
What is the InChIKey of 3-(ethenoxymethyl)-3-methyloxolane?
The InChIKey is CUDCVHZLWYCGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-9-6-8(2)4-5-10-7-8/h3H,1,4-7H2,2H3.
What are the key properties of 3-(ethenoxymethyl)-3-methyloxolane?
3-(ethenoxymethyl)-3-methyloxolane has a molecular weight of 142.20 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethenoxymethyl)-3-methyloxolane is sourced from PubChem (CID 176603173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).