3,4-dimethoxy-2-(methoxymethyl)oxolane

C8H16O4 — CID 526629

IUPAC3,4-dimethoxy-2-(methoxymethyl)oxolane
SMILESCOCC1OCC(OC)C1OC
InChIInChI=1S/C8H16O4/c1-9-4-7-8(11-3)6(10-2)5-12-7/h6-8H,4-5H2,1-3H3
InChIKeyPFPWLRZFWHVNMO-UHFFFAOYSA-N
MW176.21 g/mol
LogP0.06
Rot. Bonds4

About 3,4-dimethoxy-2-(methoxymethyl)oxolane

3,4-dimethoxy-2-(methoxymethyl)oxolane (PubChem CID 526629) has the molecular formula C8H16O4 and a molecular weight of 176.21 g/mol. Its IUPAC name is 3,4-dimethoxy-2-(methoxymethyl)oxolane.

Molecular Properties

Compound Name3,4-dimethoxy-2-(methoxymethyl)oxolane
PubChem CID526629
Molecular FormulaC8H16O4
Molecular Weight176.21 g/mol
Exact Mass176.10
IUPAC Name3,4-dimethoxy-2-(methoxymethyl)oxolane
SMILESCOCC1OCC(OC)C1OC
InChIInChI=1S/C8H16O4/c1-9-4-7-8(11-3)6(10-2)5-12-7/h6-8H,4-5H2,1-3H3
InChIKeyPFPWLRZFWHVNMO-UHFFFAOYSA-N
XLogP0.06
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-2-(methoxymethyl)oxolane?
The IUPAC name of 3,4-dimethoxy-2-(methoxymethyl)oxolane (CID 526629) is 3,4-dimethoxy-2-(methoxymethyl)oxolane.
What is the SMILES notation for 3,4-dimethoxy-2-(methoxymethyl)oxolane?
The canonical SMILES for 3,4-dimethoxy-2-(methoxymethyl)oxolane is COCC1OCC(OC)C1OC.
What is the InChIKey of 3,4-dimethoxy-2-(methoxymethyl)oxolane?
The InChIKey is PFPWLRZFWHVNMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O4/c1-9-4-7-8(11-3)6(10-2)5-12-7/h6-8H,4-5H2,1-3H3.
What are the key properties of 3,4-dimethoxy-2-(methoxymethyl)oxolane?
3,4-dimethoxy-2-(methoxymethyl)oxolane has a molecular weight of 176.21 g/mol, XLogP of 0.06, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-2-(methoxymethyl)oxolane is sourced from PubChem (CID 526629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).