4-methoxyfuran-2-ol

C5H6O3 — CID 11332448

IUPAC4-methoxyfuran-2-ol
SMILESCOc1coc(O)c1
InChIInChI=1S/C5H6O3/c1-7-4-2-5(6)8-3-4/h2-3,6H,1H3
InChIKeyGLGLDJONTJAPAD-UHFFFAOYSA-N
MW114.10 g/mol
LogP0.99
Rot. Bonds1

About 4-methoxyfuran-2-ol

4-methoxyfuran-2-ol (PubChem CID 11332448) has the molecular formula C5H6O3 and a molecular weight of 114.10 g/mol. Its IUPAC name is 4-methoxyfuran-2-ol.

Molecular Properties

Compound Name4-methoxyfuran-2-ol
PubChem CID11332448
Molecular FormulaC5H6O3
Molecular Weight114.10 g/mol
Exact Mass114.03
IUPAC Name4-methoxyfuran-2-ol
SMILESCOc1coc(O)c1
InChIInChI=1S/C5H6O3/c1-7-4-2-5(6)8-3-4/h2-3,6H,1H3
InChIKeyGLGLDJONTJAPAD-UHFFFAOYSA-N
XLogP0.99
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.10
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxyfuran-2-ol?
The IUPAC name of 4-methoxyfuran-2-ol (CID 11332448) is 4-methoxyfuran-2-ol.
What is the SMILES notation for 4-methoxyfuran-2-ol?
The canonical SMILES for 4-methoxyfuran-2-ol is COc1coc(O)c1.
What is the InChIKey of 4-methoxyfuran-2-ol?
The InChIKey is GLGLDJONTJAPAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6O3/c1-7-4-2-5(6)8-3-4/h2-3,6H,1H3.
What are the key properties of 4-methoxyfuran-2-ol?
4-methoxyfuran-2-ol has a molecular weight of 114.10 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxyfuran-2-ol is sourced from PubChem (CID 11332448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).