916596-02-6

Basic information

• Product Name: 3-Chloro-4-ethoxybenzonitrile
• Synonyms: 3-Chloro-4-ethoxybenzonitrile
• CAS NO: 916596-02-6
• Molecular Formula: C₉H₈ClNO
• Molecular Weight: 181.61892
• EINECS: -0
• Mol File: 916596-02-6.mol

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 3-Chloro-4-ethoxybenzonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 3-Chloro-4-ethoxybenzonitrile(916596-02-6)
• EPA Substance Registry System: 3-Chloro-4-ethoxybenzonitrile(916596-02-6)

Safety Data

• Hazardous Substances Data: 916596-02-6(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
3-Chloro-4-ethoxybenzonitrile is used as a building block for the production of pharmaceuticals. Its presence of both the chloro and ethoxy groups makes it a versatile starting material for the synthesis of a wide range of compounds.
Used in Agrochemical Industry:
3-Chloro-4-ethoxybenzonitrile is used as an intermediate in the synthesis of agrochemicals. Its unique structure allows for the development of new and effective agrochemical products.
Used in Specialty Chemicals Industry:
3-Chloro-4-ethoxybenzonitrile is used as a building block in the production of specialty chemicals. Its versatility and reactivity make it a valuable component in the synthesis of various specialty chemicals.
It is important to handle 3-Chloro-4-ethoxybenzonitrile with care, as it may be harmful if ingested, inhaled, or comes into contact with the skin.

InChI:InChI=1S/C9H8ClNO/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-5H,2H2,1H3

Upstream product

• 1428637-01-7 C₁₀H₁₂ClNO₂ 
• 2315-81-3 2-chloro-4-cyanophenol 
• 75-03-6 ethyl iodide 
• 25117-74-2 4-ethoxybenzonitrile 

Relevant articles and documents

COMPOUNDS AND USES THEREOF

The present invention features compounds useful in the treatment of neurological disorders. The compounds of the invention, alone or in combination with other pharmaceutically active agents, can be used for treating or preventing neurological disorders.

Room temperature C(sp2)-H oxidative chlorination: Via photoredox catalysis

Photoredox catalysis has been developed to achieve oxidative C-H chlorination of aromatic compounds using NaCl as the chlorine source and Na2S2O8 as the oxidant. The reactions occur at room temperature and exhibit exclusive selectivity for C(sp2)-H bonds over C(sp3)-H bonds. The method has been used for the chlorination of a diverse set of substrates, including the expedited synthesis of key intermediates to bioactive compounds and a drug.

Ruthenium-catalyzed intramolecular selective halogenation of O-methylbenzohydroximoyl halides: A new route to halogenated aromatic nitriles

The intramolecular halogenation of O-methylbenzohydroximoyl halides in the presence of a Ru catalyst and the ligand diphenylacetylene afforded halo substituted aromatic nitriles in a highly regioselective manner. Further, substituted nitriles were converted into substituted tetrazole derivatives in the presence of NaN3 and I2.