3-ethoxyoxetane

C5H10O2 — CID 22138513

IUPAC3-ethoxyoxetane
SMILESCCOC1COC1
InChIInChI=1S/C5H10O2/c1-2-7-5-3-6-4-5/h5H,2-4H2,1H3
InChIKeyFXYKARNVHXGOIZ-UHFFFAOYSA-N
MW102.13 g/mol
LogP0.42
Rot. Bonds2

About 3-ethoxyoxetane

3-ethoxyoxetane (PubChem CID 22138513) has the molecular formula C5H10O2 and a molecular weight of 102.13 g/mol. Its IUPAC name is 3-ethoxyoxetane.

Molecular Properties

Compound Name3-ethoxyoxetane
PubChem CID22138513
Molecular FormulaC5H10O2
Molecular Weight102.13 g/mol
Exact Mass102.07
IUPAC Name3-ethoxyoxetane
SMILESCCOC1COC1
InChIInChI=1S/C5H10O2/c1-2-7-5-3-6-4-5/h5H,2-4H2,1H3
InChIKeyFXYKARNVHXGOIZ-UHFFFAOYSA-N
XLogP0.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.13
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxyoxetane?
The IUPAC name of 3-ethoxyoxetane (CID 22138513) is 3-ethoxyoxetane.
What is the SMILES notation for 3-ethoxyoxetane?
The canonical SMILES for 3-ethoxyoxetane is CCOC1COC1.
What is the InChIKey of 3-ethoxyoxetane?
The InChIKey is FXYKARNVHXGOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2/c1-2-7-5-3-6-4-5/h5H,2-4H2,1H3.
What are the key properties of 3-ethoxyoxetane?
3-ethoxyoxetane has a molecular weight of 102.13 g/mol, XLogP of 0.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxyoxetane is sourced from PubChem (CID 22138513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).