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636231 Sigma-Aldrich

Isoxazole-5-carbonyl chloride

97%

  • CAS Number 62348-13-4

  • Empirical Formula (Hill Notation) C4H2ClNO2

  • Molecular Weight 131.52

  •  MDL number MFCD00067868

  •  PubChem Substance ID 24882763

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Isoxazoles
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.)
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.

Packaging

1, 5 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS05  GHS05
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN 3265 8 / PGII
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

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Protocols & Articles
Peer-Reviewed Papers
15

References

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