2-ethoxy-2H-oxete

C5H8O2 — CID 175705413

IUPAC2-ethoxy-2H-oxete
SMILESCCOC1C=CO1
InChIInChI=1S/C5H8O2/c1-2-6-5-3-4-7-5/h3-5H,2H2,1H3
InChIKeyXRUZSKRNVUIVAS-UHFFFAOYSA-N
MW100.12 g/mol
LogP0.89
Rot. Bonds2

About 2-ethoxy-2H-oxete

2-ethoxy-2H-oxete (PubChem CID 175705413) has the molecular formula C5H8O2 and a molecular weight of 100.12 g/mol. Its IUPAC name is 2-ethoxy-2H-oxete.

Molecular Properties

Compound Name2-ethoxy-2H-oxete
PubChem CID175705413
Molecular FormulaC5H8O2
Molecular Weight100.12 g/mol
Exact Mass100.05
IUPAC Name2-ethoxy-2H-oxete
SMILESCCOC1C=CO1
InChIInChI=1S/C5H8O2/c1-2-6-5-3-4-7-5/h3-5H,2H2,1H3
InChIKeyXRUZSKRNVUIVAS-UHFFFAOYSA-N
XLogP0.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2H-oxete?
The IUPAC name of 2-ethoxy-2H-oxete (CID 175705413) is 2-ethoxy-2H-oxete.
What is the SMILES notation for 2-ethoxy-2H-oxete?
The canonical SMILES for 2-ethoxy-2H-oxete is CCOC1C=CO1.
What is the InChIKey of 2-ethoxy-2H-oxete?
The InChIKey is XRUZSKRNVUIVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O2/c1-2-6-5-3-4-7-5/h3-5H,2H2,1H3.
What are the key properties of 2-ethoxy-2H-oxete?
2-ethoxy-2H-oxete has a molecular weight of 100.12 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2H-oxete is sourced from PubChem (CID 175705413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).