2-(ethenoxymethyl)-5-methylfuran

C8H10O2 — CID 18533724

IUPAC2-(ethenoxymethyl)-5-methylfuran
SMILESC=COCc1ccc(C)o1
InChIInChI=1S/C8H10O2/c1-3-9-6-8-5-4-7(2)10-8/h3-5H,1,6H2,2H3
InChIKeyIRVMYZZZPDTDBA-UHFFFAOYSA-N
MW138.17 g/mol
LogP2.25
Rot. Bonds3

About 2-(ethenoxymethyl)-5-methylfuran

2-(ethenoxymethyl)-5-methylfuran (PubChem CID 18533724) has the molecular formula C8H10O2 and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-(ethenoxymethyl)-5-methylfuran.

Molecular Properties

Compound Name2-(ethenoxymethyl)-5-methylfuran
PubChem CID18533724
Molecular FormulaC8H10O2
Molecular Weight138.17 g/mol
Exact Mass138.07
IUPAC Name2-(ethenoxymethyl)-5-methylfuran
SMILESC=COCc1ccc(C)o1
InChIInChI=1S/C8H10O2/c1-3-9-6-8-5-4-7(2)10-8/h3-5H,1,6H2,2H3
InChIKeyIRVMYZZZPDTDBA-UHFFFAOYSA-N
XLogP2.25
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(ethenoxymethyl)-5-methylfuran?
The IUPAC name of 2-(ethenoxymethyl)-5-methylfuran (CID 18533724) is 2-(ethenoxymethyl)-5-methylfuran.
What is the SMILES notation for 2-(ethenoxymethyl)-5-methylfuran?
The canonical SMILES for 2-(ethenoxymethyl)-5-methylfuran is C=COCc1ccc(C)o1.
What is the InChIKey of 2-(ethenoxymethyl)-5-methylfuran?
The InChIKey is IRVMYZZZPDTDBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2/c1-3-9-6-8-5-4-7(2)10-8/h3-5H,1,6H2,2H3.
What are the key properties of 2-(ethenoxymethyl)-5-methylfuran?
2-(ethenoxymethyl)-5-methylfuran has a molecular weight of 138.17 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethenoxymethyl)-5-methylfuran is sourced from PubChem (CID 18533724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).