636231

Isoxazole-5-carbonyl chloride

97%

• Empirical Formula (Hill Notation): C₄H₂ClNO₂
• CAS Number: 62348-13-4
• Molecular Weight: 131.52
• MDL number: MFCD00067868
• UNSPSC Code: 12352100
• PubChem Substance ID: 24882763
• NACRES: NA.22

Properties

• Quality Level: 200
• Assay: 97%
• refractive index: n20/D 1.4980 (lit.)
• bp: 167-168 °C (lit.)
• density: 1.362 g/mL at 25 °C (lit.)
• functional group: acyl chloride
• SMILES string: ClC(=O)c1ccno1
• InChI: 1S/C4H2ClNO2/c5-4(7)3-1-2-6-8-3/h1-2H
• InChI key: NASLINFISOTVJJ-UHFFFAOYSA-N

Description

Application

Isoxazole-5-carbonyl chloride can undergo reaction with 1-benzhydrylpiperazine to give the corresponding 1-benzhydrylpiperazine derivative, which may be used in the treatment of cancer. It can also be used in the synthesis of N-Isoxazole-5-carbonyl-1,3-diphenyl-5-amino-1H-pyrazole, which can act like potent agent in the treatment of neurological and psychiatric illness.

Safety Information

• Pictograms: GHS05
• Signal Word: Danger
• Hazard Statements: H314
• Precautionary Statements: P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363 - P405
• Hazard Classifications: Eye Dam. 1 - Skin Corr. 1B
• Storage Class Code: 8A - Combustible corrosive hazardous materials
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves