2-(methoxymethyl)-3-propyloxetane

C8H16O2 — CID 22160817

IUPAC2-(methoxymethyl)-3-propyloxetane
SMILESCCCC1COC1COC
InChIInChI=1S/C8H16O2/c1-3-4-7-5-10-8(7)6-9-2/h7-8H,3-6H2,1-2H3
InChIKeyWFXAJLKZCZXWEW-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.45
Rot. Bonds4

About 2-(methoxymethyl)-3-propyloxetane

2-(methoxymethyl)-3-propyloxetane (PubChem CID 22160817) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 2-(methoxymethyl)-3-propyloxetane.

Molecular Properties

Compound Name2-(methoxymethyl)-3-propyloxetane
PubChem CID22160817
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name2-(methoxymethyl)-3-propyloxetane
SMILESCCCC1COC1COC
InChIInChI=1S/C8H16O2/c1-3-4-7-5-10-8(7)6-9-2/h7-8H,3-6H2,1-2H3
InChIKeyWFXAJLKZCZXWEW-UHFFFAOYSA-N
XLogP1.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
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 2-(methoxymethyl)-3-propyloxetane?
The IUPAC name of 2-(methoxymethyl)-3-propyloxetane (CID 22160817) is 2-(methoxymethyl)-3-propyloxetane.
What is the SMILES notation for 2-(methoxymethyl)-3-propyloxetane?
The canonical SMILES for 2-(methoxymethyl)-3-propyloxetane is CCCC1COC1COC.
What is the InChIKey of 2-(methoxymethyl)-3-propyloxetane?
The InChIKey is WFXAJLKZCZXWEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-3-4-7-5-10-8(7)6-9-2/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-3-propyloxetane?
2-(methoxymethyl)-3-propyloxetane has a molecular weight of 144.21 g/mol, XLogP of 1.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-3-propyloxetane is sourced from PubChem (CID 22160817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).