5-Methylfurfural (C6H6O2)

Looking for routes to 5-Methylfurfural? 5-Methylfurfural presents a C6 framework, aromatic rings. Use the planner with prefilled SMILES, or copy Cc1ccc(C=O)o1 (CAS 620-02-0).

Target: 5-Methylfurfural
CAS: 620-02-0
Formula: C6H6O2
Approx. MW: 110.11
SMILES: Cc1ccc(C=O)o1
PubChem CID: 12097
Approx. carbons: C6

5-Methylfurfural structure

Properties

IUPAC name: 5-methylfuran-2-carbaldehyde
Common names: 5-METHYLFURFURAL; 5-Methylfuran-2-carbaldehyde; 5-Methyl-2-furaldehyde; 5-Methyl-2-furfural; 5-Methyl-2-furancarboxaldehyde; 2-Furancarboxaldehyde, 5-methyl-; 5-methyl-2-furancarbaldehyde; EINECS 210-622-6; Furfural, 5-methyl-; CCRIS 2921
Molecular weight: 110.11
Exact mass: 110.04
InChIKey: OUDFNZMQXZILJD-UHFFFAOYSA-N
Boiling point: 89.00 to 90.00 °C. @ 26.00 mm Hg
Density: 1.098-1.108

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5-Methylfurfural 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 5-Methylfurfural?

5-Methylfurfural has molecular formula C6H6O2. Molecular weight about 110.11 g·mol⁻¹.

What is the CAS number of 5-Methylfurfural?

The CAS Registry Number for 5-Methylfurfural is 620-02-0.

Run AI retrosynthesis for 5-Methylfurfural Target catalog AI tools overview

One click loads 5-Methylfurfural into ChemicalTool Reaction for route exploration.

Related targets

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.