1-(dimethoxymethoxy)-1,2-dimethoxyethane

C7H16O5 — CID 154193438

IUPAC1-(dimethoxymethoxy)-1,2-dimethoxyethane
SMILESCOCC(OC)OC(OC)OC
InChIInChI=1S/C7H16O5/c1-8-5-6(9-2)12-7(10-3)11-4/h6-7H,5H2,1-4H3
InChIKeyOLYDBMMIKQFNGY-UHFFFAOYSA-N
MW180.20 g/mol
LogP0.20
Rot. Bonds7

About 1-(dimethoxymethoxy)-1,2-dimethoxyethane

1-(dimethoxymethoxy)-1,2-dimethoxyethane (PubChem CID 154193438) has the molecular formula C7H16O5 and a molecular weight of 180.20 g/mol. Its IUPAC name is 1-(dimethoxymethoxy)-1,2-dimethoxyethane.

Molecular Properties

Compound Name1-(dimethoxymethoxy)-1,2-dimethoxyethane
PubChem CID154193438
Molecular FormulaC7H16O5
Molecular Weight180.20 g/mol
Exact Mass180.10
IUPAC Name1-(dimethoxymethoxy)-1,2-dimethoxyethane
SMILESCOCC(OC)OC(OC)OC
InChIInChI=1S/C7H16O5/c1-8-5-6(9-2)12-7(10-3)11-4/h6-7H,5H2,1-4H3
InChIKeyOLYDBMMIKQFNGY-UHFFFAOYSA-N
XLogP0.20
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.20
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethoxymethoxy)-1,2-dimethoxyethane?
The IUPAC name of 1-(dimethoxymethoxy)-1,2-dimethoxyethane (CID 154193438) is 1-(dimethoxymethoxy)-1,2-dimethoxyethane.
What is the SMILES notation for 1-(dimethoxymethoxy)-1,2-dimethoxyethane?
The canonical SMILES for 1-(dimethoxymethoxy)-1,2-dimethoxyethane is COCC(OC)OC(OC)OC.
What is the InChIKey of 1-(dimethoxymethoxy)-1,2-dimethoxyethane?
The InChIKey is OLYDBMMIKQFNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O5/c1-8-5-6(9-2)12-7(10-3)11-4/h6-7H,5H2,1-4H3.
What are the key properties of 1-(dimethoxymethoxy)-1,2-dimethoxyethane?
1-(dimethoxymethoxy)-1,2-dimethoxyethane has a molecular weight of 180.20 g/mol, XLogP of 0.20, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethoxymethoxy)-1,2-dimethoxyethane is sourced from PubChem (CID 154193438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).