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CAS 76469-88-0

Methyl 4-(Cyanomethyl)benzoate TCI M2341

Methyl 4-(Cyanomethyl)benzoate TCI M2341

Chemical Identity

CAS No.
76469-88-0
PubChem
CID 848548·SID 253661538
Formula
C10H9NO2
Molecular weight
175.18 g/mol
Purity
>95.0%(GC)
Reference databases
ECHA
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
methyl 4-(cyanomethyl)benzoate
SMILES
COC(=O)C1=CC=C(C=C1)CC#N
InChIKey
XRZGMNGGCZTNGE-UHFFFAOYSA-N
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Methyl 4-(Cyanomethyl)benzoate is a chemical compound widely used in organic synthesis reactions within laboratory settings. This compound serves as a key building block in the development of various organic molecules, particularly in the synthesis of heterocyclic compounds and complex molecular structures. Its unique molecular structure, featuring a benzoate group linked to a cyanomethyl chain, makes it a versatile reagent for chemical transformations. Due to its reactivity, it is often employed in substitution and condensation reactions, contributing to the creation of new functional groups in organic chemistry.

The compound's chemical properties, such as solubility in organic solvents and its ability to participate in a variety of chemical reactions, make it a preferred choice for researchers. These characteristics allow it to be effectively utilized in different synthetic pathways, enhancing the efficiency of laboratory processes. Its stability under certain conditions also contributes to its reliability in long-term storage and repeated use. This makes it a valuable resource for both academic and industrial research environments.

In Indonesian laboratories, Methyl 4-(Cyanomethyl)benzoate is commonly used in scientific research, especially in the fields of organic chemistry and pharmaceutical development. It plays a crucial role in the synthesis of various compounds, supporting advancements in drug discovery and chemical innovation. Its availability and performance make it an essential component in the toolkit of researchers working on complex chemical structures and functional group modifications.

  • Organic Synthesis: This compound is ideal for synthesizing complex organic molecules due to its reactive cyanomethyl group and benzoate functionality.
  • Heterocyclic Compound Development: Its structure supports the formation of heterocyclic rings, making it suitable for pharmaceutical and medicinal chemistry research.
  • Functional Group Modification: The compound's versatility allows it to participate in various chemical reactions, aiding in the modification of functional groups in target molecules.
  • Research in Pharmaceutical Chemistry: It is widely used in the development of new drugs, as it can be incorporated into diverse molecular frameworks.
  • Academic and Industrial Research: Its stability and reactivity make it a reliable reagent for both teaching and industrial-scale chemical synthesis.

Brand TCI
CAS number 76469-88-0
Molecular formula —
Purity —
Category Chemistry > Building Blocks > Non-Heterocyclic Building Blocks
Pack sizes Available in various quantities as per supplier specifications
Physical form Solid or liquid, depending on the specific product variant
Storage Store in a cool, dry place away from direct sunlight and moisture

Methyl 4-(Cyanomethyl)benzoate should be stored in a cool, dry environment to maintain its stability and prevent degradation. It is recommended to keep the compound in airtight containers to minimize exposure to moisture and air, which can affect its chemical integrity. Due to its reactivity, it should be handled with care, using appropriate personal protective equipment such as gloves and safety goggles. Storage should be in a location that is inaccessible to children and away from incompatible materials. Regular inspection of storage conditions is advised to ensure the compound remains in optimal condition for use in laboratory applications.

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