3-(ethenoxymethyl)furan

C7H8O2 — CID 18340923

IUPAC3-(ethenoxymethyl)furan
SMILESC=COCc1ccoc1
InChIInChI=1S/C7H8O2/c1-2-8-5-7-3-4-9-6-7/h2-4,6H,1,5H2
InChIKeyVHXPVCQIJZLBMZ-UHFFFAOYSA-N
MW124.14 g/mol
LogP1.94
Rot. Bonds3

About 3-(ethenoxymethyl)furan

3-(ethenoxymethyl)furan (PubChem CID 18340923) has the molecular formula C7H8O2 and a molecular weight of 124.14 g/mol. Its IUPAC name is 3-(ethenoxymethyl)furan.

Molecular Properties

Compound Name3-(ethenoxymethyl)furan
PubChem CID18340923
Molecular FormulaC7H8O2
Molecular Weight124.14 g/mol
Exact Mass124.05
IUPAC Name3-(ethenoxymethyl)furan
SMILESC=COCc1ccoc1
InChIInChI=1S/C7H8O2/c1-2-8-5-7-3-4-9-6-7/h2-4,6H,1,5H2
InChIKeyVHXPVCQIJZLBMZ-UHFFFAOYSA-N
XLogP1.94
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 51.94
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 3-(ethenoxymethyl)furan?
The IUPAC name of 3-(ethenoxymethyl)furan (CID 18340923) is 3-(ethenoxymethyl)furan.
What is the SMILES notation for 3-(ethenoxymethyl)furan?
The canonical SMILES for 3-(ethenoxymethyl)furan is C=COCc1ccoc1.
What is the InChIKey of 3-(ethenoxymethyl)furan?
The InChIKey is VHXPVCQIJZLBMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O2/c1-2-8-5-7-3-4-9-6-7/h2-4,6H,1,5H2.
What are the key properties of 3-(ethenoxymethyl)furan?
3-(ethenoxymethyl)furan has a molecular weight of 124.14 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethenoxymethyl)furan is sourced from PubChem (CID 18340923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).