5-(2,4-Dichlorophenyl)furfural - ≥97% , CAS No.56300-69-7

CAS: 56300-69-7 Cat. No.: D469365 分子式: C₁₁H₆Cl₂O₂ 分子量: 241.07

GRADE & PURITY ≥97%

Synonyms

EN300-31046 | SCHEMBL1728691 | FT-0679299 | Z57313835 | 5-(2,4-dichlorophenyl)furan-2-carbaldehyde | BB 0245473 | 5F-045 | MFCD00141622 | AKOS000108217 | 5-(2,4-dichlorophenyl)-2-furancarboxaldehyde | SB61462 | STK056864 | 5-(2,4-dichlorophenyl)-2-furalde

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

同義語

EN300-31046 | SCHEMBL1728691 | FT-0679299 | Z57313835 | 5-(2,4-dichlorophenyl)furan-2-carbaldehyde | BB 0245473 | 5F-045 | MFCD00141622 | AKOS000108217 | 5-(2,4-dichlorophenyl)-2-furancarboxaldehyde | SB61462 | STK056864 | 5-(2,4-dichlorophenyl)-2-furalde

仕様と純度

≥97%

保管条件

Protected from light,Store at -20°C,Argon charged

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥97%

名前と識別子

カノニカル・スマイル

C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)C=O

IUPAC Name

5-(2,4-dichlorophenyl)furan-2-carbaldehyde

InChIKey

WTXWLFKNQYWFPK-UHFFFAOYSA-N

INCHI

1S/C11H6Cl2O2/c12-7-1-3-9(10(13)5-7)11-4-2-8(6-14)15-11/h1-6H

異性体SMILES

C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)C=O

分子量

241.07

Reaxy-Rn

982331

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=982331&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Level5 Chlorobenzenes
          • Level6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: Aryl-aldehydes Aryl chlorides Heteroaromatic compounds Furans Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 1,3-dichlorobenzene - Aryl-aldehyde - Aryl chloride - Aryl halide - Furan - Heteroaromatic compound - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organochloride - Organohalogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• 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

作用メカニズム

化学的性質と物理的性質

• 感度: air sensitive
• 分子量: 241.070 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 239.974 Da
• Monoisotopic Mass: 239.974 Da
• Topological Polar Surface Area: 30.200 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 235.000
• 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