8.04012

Furfural

for synthesis

• Synonym(s): Furfural, 2-Furancarbaldehyde
• Empirical Formula (Hill Notation): C₅H₄O₂
• CAS Number: 98-01-1
• Molecular Weight: 96.08
• UNSPSC Code: 12352114
• EC Index Number: 202-627-7
• NACRES: NA.22
• MDL number: MFCD00003229
• Assay: ≥98% (GC)
• Grade: synthesis grade
• Bp: 162 °C/1013 hPa
• Vapor pressure: 1 hPa ( 20 °C)

Properties

• grade: synthesis grade
• Quality Segment: 200
• vapor pressure: 1 hPa ( 20 °C)
• assay: ≥98% (GC)
• form: liquid
• autoignition temp.: 315 °C
• potency: 65 mg/kg LD₅₀, oral (Rat)
• expl. lim.: 2.1-19.3 % (v/v)
• dilution: (for synthesis)
• bp: 162 °C/1013 hPa
• mp: -37 °C
• transition temp: flash point 60 °C
• solubility: 83 g/L
• density: 1.16 g/cm³ at 20 °C
• storage temp.: 2-30°C
• SMILES string: [o]1c(ccc1)C=O
• InChI: 1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H
• InChI key: HYBBIBNJHNGZAN-UHFFFAOYSA-N

Description

Application

• Electrocatalytic conversion of furfural: Zhu et al. reviewed the mechanisms, catalysts, and perspectives on the electrocatalytic conversion of biomass-derived furan compounds, including furfural. This process emphasizes the potential of furfural in green chemistry and chemical process optimization (Zhu et al., 2024).
• Biocatalytic production of furfural: Gong et al. explored the use of electron-rich Ru supported on N-doped coffee biochar for the selective reductive amination of furfural to furfurylamine, highlighting a novel method for furfural utilization in pharmaceutical synthesis and biomass chemical production (Gong et al., 2024).
• Use of furfural in detoxification: Wang et al. discussed the application of microalgae in the detoxification of lignocellulosic pretreatment wastewater, demonstrating furfural′s role in the sustainable management and resource utilization of wastewater, contributing to environmental and chemical process optimization (Wang et al., 2024).

Analysis Note

Assay (GC, area%): ≥ 98.0 % (a/a)
Density (d 20 °C/ 4 °C): 1.158 - 1.160
Identity (IR): passes test

Safety Information

• pictograms: GHS02,GHS06,GHS08
• signalword: Danger
• pcodes: P210 - P273 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 2 Inhalation - Acute Tox. 3 Oral - Acute Tox. 4 Dermal - Aquatic Chronic 3 - Carc. 2 - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 3 - Flammable liquids
• wgk: WGK 2
• flash_point_f: 136.4 °F - closed cup
• flash_point_c: 58 °C - closed cup
• hcodes: H226,H301,H312,H315,H319,H330,H335,H351,H412