3-(2-ethenoxyethyl)-3-ethyloxetane

C9H16O2 — CID 141483491

IUPAC3-(2-ethenoxyethyl)-3-ethyloxetane
SMILESC=COCCC1(CC)COC1
InChIInChI=1S/C9H16O2/c1-3-9(7-11-8-9)5-6-10-4-2/h4H,2-3,5-8H2,1H3
InChIKeyVNRWVOACRVLEML-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.96
Rot. Bonds5

About 3-(2-ethenoxyethyl)-3-ethyloxetane

3-(2-ethenoxyethyl)-3-ethyloxetane (PubChem CID 141483491) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 3-(2-ethenoxyethyl)-3-ethyloxetane.

Molecular Properties

Compound Name3-(2-ethenoxyethyl)-3-ethyloxetane
PubChem CID141483491
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name3-(2-ethenoxyethyl)-3-ethyloxetane
SMILESC=COCCC1(CC)COC1
InChIInChI=1S/C9H16O2/c1-3-9(7-11-8-9)5-6-10-4-2/h4H,2-3,5-8H2,1H3
InChIKeyVNRWVOACRVLEML-UHFFFAOYSA-N
XLogP1.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(Ethenoxymethyl)-4-methyloxane
CID 68560612
3-Ethyl-3-(2-methoxyethyl)oxetane
CID 89215279
3-(2-Ethenoxyethyl)-3-propyloxetane
CID 140130453
3-(3-Ethenoxypropyl)-3-methyloxetane
CID 140130454
3-(Ethenoxymethyl)-3-propyloxetane
CID 140130458
3-(2-Ethenoxyethyl)-3-methyloxetane
CID 141483488
1,5-Bis(ethenoxy)-3,3-dimethylpentane
CID 145753870
3-Ethyl-3-(2-prop-1-enoxyethyl)oxetane
CID 149734533
3-Ethyl-3-[2-(2-methylprop-1-enoxy)ethyl]oxetane
CID 150120426
3-(1-Ethenoxyethyl)-3-ethyloxetane
CID 175031746
4-(Ethenoxymethyl)-4-ethyloxane
CID 176604167

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethenoxyethyl)-3-ethyloxetane?
The IUPAC name of 3-(2-ethenoxyethyl)-3-ethyloxetane (CID 141483491) is 3-(2-ethenoxyethyl)-3-ethyloxetane.
What is the SMILES notation for 3-(2-ethenoxyethyl)-3-ethyloxetane?
The canonical SMILES for 3-(2-ethenoxyethyl)-3-ethyloxetane is C=COCCC1(CC)COC1.
What is the InChIKey of 3-(2-ethenoxyethyl)-3-ethyloxetane?
The InChIKey is VNRWVOACRVLEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-3-9(7-11-8-9)5-6-10-4-2/h4H,2-3,5-8H2,1H3.
What are the key properties of 3-(2-ethenoxyethyl)-3-ethyloxetane?
3-(2-ethenoxyethyl)-3-ethyloxetane has a molecular weight of 156.22 g/mol, XLogP of 1.96, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethenoxyethyl)-3-ethyloxetane is sourced from PubChem (CID 141483491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).