3-(dimethoxymethyl)furan

C7H10O3 — CID 12708705

IUPAC3-(dimethoxymethyl)furan
SMILESCOC(OC)c1ccoc1
InChIInChI=1S/C7H10O3/c1-8-7(9-2)6-3-4-10-5-6/h3-5,7H,1-2H3
InChIKeyKUETZVIRNLYYLC-UHFFFAOYSA-N
MW142.15 g/mol
LogP1.57
Rot. Bonds3

About 3-(dimethoxymethyl)furan

3-(dimethoxymethyl)furan (PubChem CID 12708705) has the molecular formula C7H10O3 and a molecular weight of 142.15 g/mol. Its IUPAC name is 3-(dimethoxymethyl)furan.

Molecular Properties

Compound Name3-(dimethoxymethyl)furan
PubChem CID12708705
Molecular FormulaC7H10O3
Molecular Weight142.15 g/mol
Exact Mass142.06
IUPAC Name3-(dimethoxymethyl)furan
SMILESCOC(OC)c1ccoc1
InChIInChI=1S/C7H10O3/c1-8-7(9-2)6-3-4-10-5-6/h3-5,7H,1-2H3
InChIKeyKUETZVIRNLYYLC-UHFFFAOYSA-N
XLogP1.57
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.15
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 3-(dimethoxymethyl)furan?
The IUPAC name of 3-(dimethoxymethyl)furan (CID 12708705) is 3-(dimethoxymethyl)furan.
What is the SMILES notation for 3-(dimethoxymethyl)furan?
The canonical SMILES for 3-(dimethoxymethyl)furan is COC(OC)c1ccoc1.
What is the InChIKey of 3-(dimethoxymethyl)furan?
The InChIKey is KUETZVIRNLYYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O3/c1-8-7(9-2)6-3-4-10-5-6/h3-5,7H,1-2H3.
What are the key properties of 3-(dimethoxymethyl)furan?
3-(dimethoxymethyl)furan has a molecular weight of 142.15 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethoxymethyl)furan is sourced from PubChem (CID 12708705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).