5-(Methoxymethyl)furan-2-carbaldehyde - ≥97% , CAS No.1917-64-2

CAS: 1917-64-2 Cat. No.: M191811 Peso molecular: 140.14 Número EC: 700-511-5

GRADE & PURITY ≥97%

Synonyms

5-(Methoxymethyl)-2-furancarboxaldehyde | UNII-5XBV4H5CX7 | 2-Furancarboxaldehyde, 5-(methoxymethyl)- | 5-methoxymethylfurfural | 5-(methoxymethyl)furan-2-carbaldehyde | 5-(METHOXYMETHYL)-2-FURALDEHYDE | MFCD02253954 | 5-Methoxymethylfuran-2-carbaldehyde

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

5-(Methoxymethyl)-2-furancarboxaldehyde | UNII-5XBV4H5CX7 | 2-Furancarboxaldehyde, 5-(methoxymethyl)- | 5-methoxymethylfurfural | 5-(methoxymethyl)furan-2-carbaldehyde | 5-(METHOXYMETHYL)-2-FURALDEHYDE | MFCD02253954 | 5-Methoxymethylfuran-2-carbaldehyde

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504754851
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754851
• Sonrisas canónicas: COCC1=CC=C(O1)C=O
• IUPAC Name: 5-(methoxymethyl)furan-2-carbaldehyde
• InChIKey: ASHVULSQMDWKFO-UHFFFAOYSA-N
• INCHI: 1S/C7H8O3/c1-9-5-7-3-2-6(4-8)10-7/h2-4H,5H2,1H3
• Isómeros SMILES: COCC1=CC=C(O1)C=O
• Peso molecular: 140.14
• Reaxy-Rn: 123744
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=123744&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Aldehydes
          • Level6 Aryl-aldehydes

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Aldehydes
• Direct Parent: Aryl-aldehydes
• Alternative Parents: Heteroaromatic compounds Furans Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl-aldehyde - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aryl-aldehydes. These are compounds containing an aldehyde group directly attached to an aromatic ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Peso molecular: 140.140 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 140.047 Da
• Monoisotopic Mass: 140.047 Da
• Topological Polar Surface Area: 39.400 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 113.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Chun Chang, Shijie Wang, Pengkun Guo, Guizhuan Xu, Xiaoyang Zheng, Chaojun Du, Youzhou Jiao.  (2022)  Metal sulfate-catalyzed methanolysis of cellulose at high solid loadings: Heterogeneous degradation kinetics and levulinate synthesis.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.139873]

2. Sibo Zhao, Xuezheng Huang, Zhenli Yan, Chun Chang, Guizhuan Xu, Chaojun Du, Youzhou Jiao, Zhiyong Chen.  (2021)  One-pot conversion of wheat straw into biobased chemicals in methanol/water medium using cheap mixed acid catalyst.  JOURNAL OF THE SCIENCE OF FOOD AND AGRICULTURE,  102  (7): (2826-2834).  [PMID:34738637] [10.1002/jsfa.11623]

3. Zhao Sibo, Wang Zihua, Chang Chun, Li Pan, Xu Guizhuan, Pang Shusheng.  (2021)  Enhanced production of levulinic acid/ester from furfural residue via pretreatment and two-stage alcoholysis.  Biomass Conversion and Biorefinery,  13  (4): (2933-2946).  [PMID:] [10.1007/s13399-021-01307-1]

4. Junfeng Feng, Jianchun Jiang, Junming Xu, Zhongzhi Yang.  (2015)  One-step method to produce methyl-D-glucoside from lignocellulosic biomass.  RSC Advances,  5  (48): (38783-38791).  [PMID:] [10.1039/C5RA04514B]

5. Zhe-Hui Zhang, Meng-Ying Liu, Zhuohua Sun, Katalin Barta, Tong-Qi Yuan.  (2024)  Simple building blocks from forestry residues via convergent catalytic pathways.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.153942]

6. Jinghua Wang, Jiangang Wang, Hongyou Cui.  (2025)  Formylation-mediated pretreatment: Enabling high-yield production of methyl levulinate from cellulose at high substrate loading.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.167667]

7. Xiangbiao Li, Hu Li, Qingmei Ge, Wenfeng Zhao, Hang Cong.  (2025)  Bimetallic synergy in tin-modified zeolites for highly efficient conversion of cellulose to methyl levulinate.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,      [PMID:] [10.1016/j.colsurfa.2025.138198]

8. Chenfeng Li, Jiahao Ju, Beizhan Li, Jilei Xu, Xin Su, Zuoyi Xiao, Qingda An, Jiahui Huang.  (2026)  Efficient Production of 5-Methoxymethyl-2-furfural from Fructose Catalyzed by Amide-Modified Resin.  Catalysts,  16  (3): (264).  [PMID:] [10.3390/catal16030264]

9. Yuang Ma, Yihui Zhang, Huixia Ma, Yaolan Yang, Wenhua Zhou, Wentao Jin, Chao Chen, Jianghao Wang, Bolong Li, Huiping Ji, Feng Zhou, Kai Qiao, Zhenyu Zhang, Haoan Fan, Jie Fu.  (2026)  Intermediate Stabilization by Quaternary Ammonium Salts for One-Pot Synthesis of 5-Methoxymethylfurfural.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.6c00133]