2-(ethenoxymethyl)-2-ethyloxolane

C9H16O2 — CID 176604059

IUPAC2-(ethenoxymethyl)-2-ethyloxolane
SMILESC=COCC1(CC)CCCO1
InChIInChI=1S/C9H16O2/c1-3-9(8-10-4-2)6-5-7-11-9/h4H,2-3,5-8H2,1H3
InChIKeyPMFXVTMBEKUXAX-UHFFFAOYSA-N
MW156.22 g/mol
LogP2.11
Rot. Bonds4

About 2-(ethenoxymethyl)-2-ethyloxolane

2-(ethenoxymethyl)-2-ethyloxolane (PubChem CID 176604059) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 2-(ethenoxymethyl)-2-ethyloxolane.

Molecular Properties

Compound Name2-(ethenoxymethyl)-2-ethyloxolane
PubChem CID176604059
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name2-(ethenoxymethyl)-2-ethyloxolane
SMILESC=COCC1(CC)CCCO1
InChIInChI=1S/C9H16O2/c1-3-9(8-10-4-2)6-5-7-11-9/h4H,2-3,5-8H2,1H3
InChIKeyPMFXVTMBEKUXAX-UHFFFAOYSA-N
XLogP2.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 52.11
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

2-Ethyl-2-[(2-ethyloxolan-2-yl)methoxymethyl]oxolane
CID 66706015
2-(Ethoxymethyl)-2-ethyloxolane
CID 91255718
2-Ethyl-2-(propoxymethyl)oxolane
CID 91803070
4-Ethenoxy-4-(ethenoxymethyl)-1-ethoxyhexane
CID 175329752
2-(Ethenoxymethyl)-2-methyloxolane
CID 176603236
2-ethyl-2-[[(E)-prop-1-enoxy]methyl]oxolane
CID 176603514
2-(2-Ethenoxyethyl)-2-methyloxolane
CID 176603747
2-Ethyl-2-(2-methylprop-1-enoxymethyl)oxolane
CID 176604121
3-(3-Ethenoxypropyl)-3-ethyloxolane
CID 176604524
2-(3-Ethenoxypropyl)-2-ethyl-1,4-dioxane
CID 176605139
3-(3-Ethenoxypropyl)oxolane
CID 176605175

Frequently Asked Questions

What is the IUPAC name of 2-(ethenoxymethyl)-2-ethyloxolane?
The IUPAC name of 2-(ethenoxymethyl)-2-ethyloxolane (CID 176604059) is 2-(ethenoxymethyl)-2-ethyloxolane.
What is the SMILES notation for 2-(ethenoxymethyl)-2-ethyloxolane?
The canonical SMILES for 2-(ethenoxymethyl)-2-ethyloxolane is C=COCC1(CC)CCCO1.
What is the InChIKey of 2-(ethenoxymethyl)-2-ethyloxolane?
The InChIKey is PMFXVTMBEKUXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-3-9(8-10-4-2)6-5-7-11-9/h4H,2-3,5-8H2,1H3.
What are the key properties of 2-(ethenoxymethyl)-2-ethyloxolane?
2-(ethenoxymethyl)-2-ethyloxolane has a molecular weight of 156.22 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethenoxymethyl)-2-ethyloxolane is sourced from PubChem (CID 176604059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).