3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane

C14H28O4 — CID 58827383

IUPAC3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane
SMILESCCOC(C)COC(C)COCC1(CC)COC1
InChIInChI=1S/C14H28O4/c1-5-14(10-16-11-14)9-15-7-12(3)18-8-13(4)17-6-2/h12-13H,5-11H2,1-4H3
InChIKeyBPQUHQFQHMOLDW-UHFFFAOYSA-N
MW260.37 g/mol
LogP2.26
Rot. Bonds10

About 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane

3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane (PubChem CID 58827383) has the molecular formula C14H28O4 and a molecular weight of 260.37 g/mol. Its IUPAC name is 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane.

Molecular Properties

Compound Name3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane
PubChem CID58827383
Molecular FormulaC14H28O4
Molecular Weight260.37 g/mol
Exact Mass260.20
IUPAC Name3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane
SMILESCCOC(C)COC(C)COCC1(CC)COC1
InChIInChI=1S/C14H28O4/c1-5-14(10-16-11-14)9-15-7-12(3)18-8-13(4)17-6-2/h12-13H,5-11H2,1-4H3
InChIKeyBPQUHQFQHMOLDW-UHFFFAOYSA-N
XLogP2.26
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.37
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane?
The IUPAC name of 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane (CID 58827383) is 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane.
What is the SMILES notation for 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane?
The canonical SMILES for 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane is CCOC(C)COC(C)COCC1(CC)COC1.
What is the InChIKey of 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane?
The InChIKey is BPQUHQFQHMOLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O4/c1-5-14(10-16-11-14)9-15-7-12(3)18-8-13(4)17-6-2/h12-13H,5-11H2,1-4H3.
What are the key properties of 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane?
3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane has a molecular weight of 260.37 g/mol, XLogP of 2.26, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-ethoxypropoxy)propoxymethyl]-3-ethyloxetane is sourced from PubChem (CID 58827383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).