69000-39-1

Basic information

• Product Name: 2-CHLORO-N-(3-METHYLISOXAZOL-5-YL)ACETAMIDE
• Synonyms: Acetamide, 2-chloro-N-(3-methyl-5-isoxazolyl)-
• CAS NO: 69000-39-1
• Molecular Formula: C6H7ClN2O2
• Molecular Weight: 174.59
• Mol File: 69000-39-1.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 374.4°C at 760 mmHg
• Flash Point: 180.2°C
• Appearance: /
• Density: 1.383g/cm³
• Vapor Pressure: 8.4E-06mmHg at 25°C
• Refractive Index: 1.556
• CAS DataBase Reference: 2-CHLORO-N-(3-METHYLISOXAZOL-5-YL)ACETAMIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CHLORO-N-(3-METHYLISOXAZOL-5-YL)ACETAMIDE(69000-39-1)
• EPA Substance Registry System: 2-CHLORO-N-(3-METHYLISOXAZOL-5-YL)ACETAMIDE(69000-39-1)

Safety Data

• Hazardous Substances Data: 69000-39-1(Hazardous Substances Data)

Usage

General Description

2-CHLORO-N-(3-METHYLISOXAZOL-5-YL)ACETAMIDE is a chemical compound that contains a chloro group, a methylisoxazol-5-yl group, and an acetamide group. It is commonly used in medicinal and pharmaceutical research and development as a building block for the synthesis of various compounds. The presence of the chloro group makes it suitable for use as a reactant in organic synthesis reactions, and the presence of the acetamide group makes it a potential pharmacophore for drug design. Additionally, the presence of the methylisoxazol-5-yl group gives the compound specific pharmacological properties that can be targeted for the development of novel drugs. Overall, 2-CHLORO-N-(3-METHYLISOXAZOL-5-YL)ACETAMIDE is a versatile chemical with potential applications in drug discovery and development.

InChI:InChI=1/C6H7ClN2O2/c1-4-2-6(11-9-4)8-5(10)3-7/h2H,3H2,1H3,(H,8,10)

Upstream product

• 14678-02-5 5-amino-3-methylisoxazole 
• 79-04-9 chloroacetyl chloride 

Relevant articles and documents

Synthesis, DFT Study, and Antitumor Activity of Some New Heterocyclic Compounds Incorporating Isoxazole Moiety

Thiazolidin-4-one derivative 3 was synthesized by the transformation of chloroacetamide derivative 2 with NH4SCN.The condensation of 3 with p-anisaldehyde afforded the corresponding arylidene derivative 4. Also, the alkylation of chloroacetamide derivative 2 with different heterocyclic compounds was investigated. Annulation of 5-amino-3-methylisoxazole (1) with α-halocarbonyl compounds 12 and 14 furnished pyrrolo[3,2-d]isoxazole and isoxazolo[5,4-b]azepin-6-one derivatives 13 and 15, respectively, while reaction of 1 with 1-chloro-4-(chloromethyl)benzene gave the monoalkylated product 17. The newly synthesized compounds were screened for their antitumor activity, and the geometry optimizations are in a good agreement with the experimentally observed data.

Isoxazole phosphates and phosphonates

Insecticidally active compounds are disclosed, defined by the general formula STR1 in which R is hydrogen or methyl; R1 is hydrogen or methyl; R2 is a member selected from the group consisting of methyl, methoxy, ethyl, and ethoxy; R3 is alkoxy having 1 to 6 carbon atoms; and X is oxygen or sulfur.