1,4-Difluoro-2,5-dimethoxybenzene - ≥99% , CAS No.199866-90-5

CAS: 199866-90-5 Cat. No.: D168336 Peso molecular: 174.14 Número EC: 606-413-8

GRADE & PURITY ≥99%

Synonyms

1,4-Difluoro-2,5-dimethoxybenzene, 99% | SCHEMBL2937347 | 2,5-difluoro-1,4-dimethoxybenzene | 1,4-Difluoro-2,5-dimethoxybenzene | 1,4-difluoro-2,5-dimethoxy-benzene | FT-0606870 | AS-75861 | MFCD00142553 | AKOS015890129 | A814139 | InChI=1/C8H8F2O2/c1-11-

Storage

Room temperature

Shipped In

Normal

Descripción general

Product Application:

1,4-difluoro-2,5-di Methoxy group benzene is a suitable reagent for studying the direct anodic electrodeposition of Polypyrrole, poly (3,4-ethylenedioxythiophene) and Polythiophene on copper electrode. It can be used for the following studies:
1、 Synthesis of 7-fluoro-5,8-di Methoxy group 1-naphthol;
2、As a novel precursor for the iterative double benzyl furan Diels Alder reaction;
3、Synthesis of 1,4-bis (phosphonyl) -2,5-difluoro-3,6-di Methoxy group benzene

Specifications

Sinónimos

1, 4-Difluoro-2, 5-dimethoxybenzene, 99% | SCHEMBL2937347 | 2, 5-difluoro-1, 4-dimethoxybenzene | 1, 4-Difluoro-2, 5-dimethoxybenzene | 1, 4-difluoro-2, 5-dimethoxy-benzene | FT-0606870 | AS-75861 | MFCD00142553 | AKOS015890129 | A814139 | InChI=1/C8H8F2O2/c1-11-

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

• Sonrisas canónicas: COC1=CC(=C(C=C1F)OC)F
• IUPAC Name: 1,4-difluoro-2,5-dimethoxybenzene
• InChIKey: QNQUBUBFPGHXAL-UHFFFAOYSA-N
• INCHI: 1S/C8H8F2O2/c1-11-7-3-6(10)8(12-2)4-5(7)9/h3-4H,1-2H3
• Isómeros SMILES: COC1=CC(=C(C=C1F)OC)F
• WGK Alemania: 3
• Peso molecular: 174.14
• Reaxy-Rn: 8052724
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8052724&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Methoxybenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Methoxybenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Dimethoxybenzenes
• Alternative Parents: Phenoxy compounds Anisoles Fluorobenzenes Alkyl aryl ethers Aryl fluorides Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
• 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

• Punto de fusión (°C): 123-125°C
• Peso molecular: 174.140 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 174.049 Da
• Monoisotopic Mass: 174.049 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 127.000
• 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