3-(prop-2-enoxymethyl)furan

C8H10O2 — CID 86185128

IUPAC3-(prop-2-enoxymethyl)furan
SMILESC=CCOCc1ccoc1
InChIInChI=1S/C8H10O2/c1-2-4-9-6-8-3-5-10-7-8/h2-3,5,7H,1,4,6H2
InChIKeyRYJOSSYCUVMYGA-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.98
Rot. Bonds4

About 3-(prop-2-enoxymethyl)furan

3-(prop-2-enoxymethyl)furan (PubChem CID 86185128) has the molecular formula C8H10O2 and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-(prop-2-enoxymethyl)furan.

Molecular Properties

Compound Name3-(prop-2-enoxymethyl)furan
PubChem CID86185128
Molecular FormulaC8H10O2
Molecular Weight138.17 g/mol
Exact Mass138.07
IUPAC Name3-(prop-2-enoxymethyl)furan
SMILESC=CCOCc1ccoc1
InChIInChI=1S/C8H10O2/c1-2-4-9-6-8-3-5-10-7-8/h2-3,5,7H,1,4,6H2
InChIKeyRYJOSSYCUVMYGA-UHFFFAOYSA-N
XLogP1.98
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(prop-2-enoxymethyl)furan?
The IUPAC name of 3-(prop-2-enoxymethyl)furan (CID 86185128) is 3-(prop-2-enoxymethyl)furan.
What is the SMILES notation for 3-(prop-2-enoxymethyl)furan?
The canonical SMILES for 3-(prop-2-enoxymethyl)furan is C=CCOCc1ccoc1.
What is the InChIKey of 3-(prop-2-enoxymethyl)furan?
The InChIKey is RYJOSSYCUVMYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2/c1-2-4-9-6-8-3-5-10-7-8/h2-3,5,7H,1,4,6H2.
What are the key properties of 3-(prop-2-enoxymethyl)furan?
3-(prop-2-enoxymethyl)furan has a molecular weight of 138.17 g/mol, XLogP of 1.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(prop-2-enoxymethyl)furan is sourced from PubChem (CID 86185128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).