3-ethyl-2,5-dimethoxyoxolane

C8H16O3 — CID 3022858

IUPAC3-ethyl-2,5-dimethoxyoxolane
SMILESCCC1CC(OC)OC1OC
InChIInChI=1S/C8H16O3/c1-4-6-5-7(9-2)11-8(6)10-3/h6-8H,4-5H2,1-3H3
InChIKeyMHQJXBOSOJIRBZ-UHFFFAOYSA-N
MW160.21 g/mol
LogP1.38
Rot. Bonds3

About 3-ethyl-2,5-dimethoxyoxolane

3-ethyl-2,5-dimethoxyoxolane (PubChem CID 3022858) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is 3-ethyl-2,5-dimethoxyoxolane.

Molecular Properties

Compound Name3-ethyl-2,5-dimethoxyoxolane
PubChem CID3022858
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name3-ethyl-2,5-dimethoxyoxolane
SMILESCCC1CC(OC)OC1OC
InChIInChI=1S/C8H16O3/c1-4-6-5-7(9-2)11-8(6)10-3/h6-8H,4-5H2,1-3H3
InChIKeyMHQJXBOSOJIRBZ-UHFFFAOYSA-N
XLogP1.38
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Dimethoxymethyl)-2-methoxyoxolane
CID 11052183
3-(Diethoxymethyl)-2-ethoxyoxolane
CID 11579424
1,3-Dioxolane, 2-(1-methylbutyl)-
CID 86517
1,1-Bis(2-methylpropoxy)pentane
CID 53421444
Furan, tetrahydro-2-(pentyloxy)-
CID 11116321
2-Isobutoxytetrahydrofuran
CID 12362163
2-Butoxy-4-butyltetrahydrofuran
CID 12794833
3-Methyl-2-ethoxytetrahydro-furan
CID 85787048
1-[1-(3-Methylbutoxy)ethoxy]pentane
CID 53428150
2-(3-Methylbutyl)-1,3-dioxolane
CID 10920635
2-Pentan-3-yl-1,3-dioxolane
CID 15751045
5-Ethyl-2-methyl-1,3-dioxepane
CID 53669817

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2,5-dimethoxyoxolane?
The IUPAC name of 3-ethyl-2,5-dimethoxyoxolane (CID 3022858) is 3-ethyl-2,5-dimethoxyoxolane.
What is the SMILES notation for 3-ethyl-2,5-dimethoxyoxolane?
The canonical SMILES for 3-ethyl-2,5-dimethoxyoxolane is CCC1CC(OC)OC1OC.
What is the InChIKey of 3-ethyl-2,5-dimethoxyoxolane?
The InChIKey is MHQJXBOSOJIRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3/c1-4-6-5-7(9-2)11-8(6)10-3/h6-8H,4-5H2,1-3H3.
What are the key properties of 3-ethyl-2,5-dimethoxyoxolane?
3-ethyl-2,5-dimethoxyoxolane has a molecular weight of 160.21 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2,5-dimethoxyoxolane is sourced from PubChem (CID 3022858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).