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CAS 17046-22-9

Butyl Isocyanatoacetate TCI I0358

Butyl Isocyanatoacetate TCI I0358

Chemical Identity

CAS No.
17046-22-9
PubChem
CID 86921·SID 87571712
Formula
C7H11NO3
Molecular weight
157.17 g/mol
Purity
>97.0%(GC)
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
butyl 2-isocyanatoacetate
SMILES
CCCCOC(=O)CN=C=O
InChIKey
RMZSOGJUEUFCBK-UHFFFAOYSA-N
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Butyl Isocyanatoacetate (BIA) is a chemical compound widely used as a building block in organic synthesis. It plays a crucial role in laboratories by enabling the creation of complex molecular structures through its reactive functional groups. This compound is particularly valuable for its versatility in chemical reactions, especially in substitution and bond-forming processes. Its ability to participate in a wide range of reactions makes it an essential tool for chemists working on diverse synthetic pathways.

The high reactivity of BIA is primarily due to its isocyanate group, which is highly active and readily reacts with amines, alcohols, and water. This reactivity makes it a preferred choice for applications requiring efficient bond formation. Additionally, BIA exhibits stability under certain conditions, which facilitates its storage and use over extended periods. These properties contribute to its widespread use in both research and industrial settings.

In Indonesian laboratories, BIA is commonly used in organic chemistry research, especially in pharmaceutical and material science fields. Its relevance lies in its ability to serve as a precursor for compounds with specific structural requirements, such as enzyme inhibitors or synthetic materials. The compound's flexibility and reactivity make it a valuable resource for researchers aiming to develop new compounds with tailored properties.

  • Synthesis of heterocyclic compounds for drug development due to its reactivity and ability to form complex structures.
  • Creation of synthetic materials with specific functional groups through efficient bond-forming reactions.
  • Development of enzyme inhibitors by providing a versatile platform for molecular modification.
  • Research in organic chemistry requiring flexible building blocks for structural diversity.
  • Preparation of compounds with tailored properties for pharmaceutical and industrial applications.

Brand TCI
CAS number 17046-22-9
Molecular formula —
Purity —
Category Chemistry > Building Blocks > Non-Heterocyclic Building Blocks
Pack sizes Available in various quantities as per standard supplier offerings
Physical form Liquid
Storage Store in a cool, dry place away from moisture and direct sunlight

Butyl Isocyanatoacetate should be stored in a cool, dry environment to maintain its stability and reactivity. It is recommended to use sealed containers to prevent exposure to moisture and air, which can affect its chemical integrity. Due to its reactive nature, it should be handled in a well-ventilated area to minimize inhalation risks. Proper personal protective equipment, such as gloves and goggles, should be worn during handling. The compound should be kept away from incompatible substances like strong bases or acids to avoid unwanted reactions. Regular monitoring of storage conditions ensures the compound remains suitable for use in laboratory applications.

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