5-Hydroxymethylfurfural

• CAS: 67-47-0
• Catalog Number: ACM67470-2
• Category: Inhibitors
• Molecular Weight: 126.11
• Molecular Formula: C6H6O3
• Description: 5-Hydroxymethylfurfural (2-Hydroxymethyl-5-furfural), derived from Cornus officinalis, inhibits yeast growth and fermentation as stressors.
• Synonyms: 5-Hydroxymethyl-2-fluraldehyde
• IUPAC Name: 5-(Hydroxymethyl)furan-2-carbaldehyde
• Canonical SMILES: C1=C(OC(=C1)C=O)CO
• InChI: InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
• InChI Key: NOEGNKMFWQHSLB-UHFFFAOYSA-N
• Boiling Point: 114-116 °C /1mmHg
• Melting Point: 28-34 °C
• Flash Point: 175 °F
• Density: 1.243 g/ml
• Solubility: Soluble in water, alcohol, ethyl acetate, acetone, dimethylformamide, benzene, ether and chloroform
• Appearance: <30°C Solid,>34°C Liquid
• Storage: Pure form-20°C, 3 years; In solvent-80°C, 6 months; -20°C, 1 month.
• Exact Mass: 126.031694049
• Monoisotopic Mass: 126.031694049
• Physical State: Liquid or crystalline powder
• Refractive Index: n20/D 1.562(lit.)
• Shipping: Can be shipped at room temperature, where not in use may vary.
• Solubility In Water: Soluble
• Source: PlantsCornaceaeCornus officinalis Sieb. et Zucc.
• Storage Conditions: 2-8 °C
• Topological Polar Surface Area: 50.4 Ų

Synthetic Use

Upstream Synthesis Route 1

• 2280-44-6

• 98-00-0
• 1192-79-6
• 67-47-0
• 28564-83-2
• 1072-83-9

Reference: [1] Agricultural and Biological Chemistry, 1982, vol. 46, # 10, p. 2599 - 2600

Upstream Synthesis Route 2

• 57-48-7

• 67-47-0
• 62147-49-3

Reference: [1] RSC Advances, 2015, vol. 5, # 110, p. 90952 - 90959

Upstream Synthesis Route 3

• 57-48-7

• 67-47-0
• 62147-49-3
• 64-18-6
• 10326-41-7

Reference: [1] RSC Advances, 2015, vol. 5, # 110, p. 90952 - 90959

Downstream Synthesis Route 1

• 67-47-0

• 6338-41-6

Reference: [1]Patent: WO2016/202858,2016,A1 .Location in patent: Page/Page column 53

Downstream Synthesis Route 2

• 67-47-0
• 7469-77-4

• 101412-90-2

Reference: [1]Chemical and pharmaceutical bulletin,1985,vol. 33,p. 2862 - 2865

* For details of the synthesis route, please refer to the original source to ensure accuracy.