3-methoxyoxetane

C4H8O2 — CID 22138511

IUPAC3-methoxyoxetane
SMILESCOC1COC1
InChIInChI=1S/C4H8O2/c1-5-4-2-6-3-4/h4H,2-3H2,1H3
InChIKeyWCPLWTYNTSHPIU-UHFFFAOYSA-N
MW88.11 g/mol
LogP0.03
Rot. Bonds1

About 3-methoxyoxetane

3-methoxyoxetane (PubChem CID 22138511) has the molecular formula C4H8O2 and a molecular weight of 88.11 g/mol. Its IUPAC name is 3-methoxyoxetane.

Molecular Properties

Compound Name3-methoxyoxetane
PubChem CID22138511
Molecular FormulaC4H8O2
Molecular Weight88.11 g/mol
Exact Mass88.05
IUPAC Name3-methoxyoxetane
SMILESCOC1COC1
InChIInChI=1S/C4H8O2/c1-5-4-2-6-3-4/h4H,2-3H2,1H3
InChIKeyWCPLWTYNTSHPIU-UHFFFAOYSA-N
XLogP0.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.11
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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CID 140978253
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CID 156869160
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Frequently Asked Questions

What is the IUPAC name of 3-methoxyoxetane?
The IUPAC name of 3-methoxyoxetane (CID 22138511) is 3-methoxyoxetane.
What is the SMILES notation for 3-methoxyoxetane?
The canonical SMILES for 3-methoxyoxetane is COC1COC1.
What is the InChIKey of 3-methoxyoxetane?
The InChIKey is WCPLWTYNTSHPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2/c1-5-4-2-6-3-4/h4H,2-3H2,1H3.
What are the key properties of 3-methoxyoxetane?
3-methoxyoxetane has a molecular weight of 88.11 g/mol, XLogP of 0.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxyoxetane is sourced from PubChem (CID 22138511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).