3-[3-(2-methoxyethoxy)propyl]oxetane

C9H18O3 — CID 67170238

IUPAC3-[3-(2-methoxyethoxy)propyl]oxetane
SMILESCOCCOCCCC1COC1
InChIInChI=1S/C9H18O3/c1-10-5-6-11-4-2-3-9-7-12-8-9/h9H,2-8H2,1H3
InChIKeyUKFCTHNRJMCXFJ-UHFFFAOYSA-N
MW174.24 g/mol
LogP1.08
Rot. Bonds7

About 3-[3-(2-methoxyethoxy)propyl]oxetane

3-[3-(2-methoxyethoxy)propyl]oxetane (PubChem CID 67170238) has the molecular formula C9H18O3 and a molecular weight of 174.24 g/mol. Its IUPAC name is 3-[3-(2-methoxyethoxy)propyl]oxetane.

Molecular Properties

Compound Name3-[3-(2-methoxyethoxy)propyl]oxetane
PubChem CID67170238
Molecular FormulaC9H18O3
Molecular Weight174.24 g/mol
Exact Mass174.13
IUPAC Name3-[3-(2-methoxyethoxy)propyl]oxetane
SMILESCOCCOCCCC1COC1
InChIInChI=1S/C9H18O3/c1-10-5-6-11-4-2-3-9-7-12-8-9/h9H,2-8H2,1H3
InChIKeyUKFCTHNRJMCXFJ-UHFFFAOYSA-N
XLogP1.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(3-Butoxypropyl)-3-fluorooxetane
CID 131968339
3-[3-[(2-Methylpropan-2-yl)oxy]propyl]oxetane
CID 171454077
2-(1-Butoxypropan-2-yl)oxetane
CID 174753174
1,3-Bis(ethoxymethyl)cyclobutane
CID 10821082
1,5-Diethoxy-2-methylpentane
CID 54406032
5-Methoxy-2-methyl-1-propoxypentane
CID 57215841
1-(2-Methoxyethoxy)-4-methylpentane
CID 58479266
13-Propan-2-yl-1,4,7,10-tetraoxacyclopentadecane
CID 59686750
4-Methyl-1-[2-(3-methylbutoxy)ethoxy]pentane
CID 60119378
3-[2-(3-Methylpentoxy)ethoxymethyl]oxetane
CID 67047408
3-(3-Methoxy-2-methylpropyl)oxetane
CID 70362391
13-Methyl-1,4,7,10-tetraoxacyclopentadecane
CID 89291115

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methoxyethoxy)propyl]oxetane?
The IUPAC name of 3-[3-(2-methoxyethoxy)propyl]oxetane (CID 67170238) is 3-[3-(2-methoxyethoxy)propyl]oxetane.
What is the SMILES notation for 3-[3-(2-methoxyethoxy)propyl]oxetane?
The canonical SMILES for 3-[3-(2-methoxyethoxy)propyl]oxetane is COCCOCCCC1COC1.
What is the InChIKey of 3-[3-(2-methoxyethoxy)propyl]oxetane?
The InChIKey is UKFCTHNRJMCXFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O3/c1-10-5-6-11-4-2-3-9-7-12-8-9/h9H,2-8H2,1H3.
What are the key properties of 3-[3-(2-methoxyethoxy)propyl]oxetane?
3-[3-(2-methoxyethoxy)propyl]oxetane has a molecular weight of 174.24 g/mol, XLogP of 1.08, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methoxyethoxy)propyl]oxetane is sourced from PubChem (CID 67170238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).