3-ethoxy-3-propan-2-yloxetane

C8H16O2 — CID 155622548

IUPAC3-ethoxy-3-propan-2-yloxetane
SMILESCCOC1(C(C)C)COC1
InChIInChI=1S/C8H16O2/c1-4-10-8(7(2)3)5-9-6-8/h7H,4-6H2,1-3H3
InChIKeyUBQLSCSCDCWSQT-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.45
Rot. Bonds3

About 3-ethoxy-3-propan-2-yloxetane

3-ethoxy-3-propan-2-yloxetane (PubChem CID 155622548) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 3-ethoxy-3-propan-2-yloxetane.

Molecular Properties

Compound Name3-ethoxy-3-propan-2-yloxetane
PubChem CID155622548
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name3-ethoxy-3-propan-2-yloxetane
SMILESCCOC1(C(C)C)COC1
InChIInChI=1S/C8H16O2/c1-4-10-8(7(2)3)5-9-6-8/h7H,4-6H2,1-3H3
InChIKeyUBQLSCSCDCWSQT-UHFFFAOYSA-N
XLogP1.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-3-propan-2-yloxetane?
The IUPAC name of 3-ethoxy-3-propan-2-yloxetane (CID 155622548) is 3-ethoxy-3-propan-2-yloxetane.
What is the SMILES notation for 3-ethoxy-3-propan-2-yloxetane?
The canonical SMILES for 3-ethoxy-3-propan-2-yloxetane is CCOC1(C(C)C)COC1.
What is the InChIKey of 3-ethoxy-3-propan-2-yloxetane?
The InChIKey is UBQLSCSCDCWSQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-4-10-8(7(2)3)5-9-6-8/h7H,4-6H2,1-3H3.
What are the key properties of 3-ethoxy-3-propan-2-yloxetane?
3-ethoxy-3-propan-2-yloxetane has a molecular weight of 144.21 g/mol, XLogP of 1.45, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-3-propan-2-yloxetane is sourced from PubChem (CID 155622548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).