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5-Isopropylisoxazole-3-carboxylic acid Structure

5-Isopropylisoxazole-3-carboxylic acid

  • Product Name5-Isopropylisoxazole-3-carboxylic acid
  • CAS89776-74-9
  • CBNumberCB5223666
  • MFC7H9NO3
  • MW155.15
  • MDL NumberMFCD06738923
  • MOL File89776-74-9.mol

Chemical Properties

Melting point: 69-73 °C(lit.)
Boiling point: 298.2±28.0 °C(Predicted)
Density  1.211±0.06 g/cm3(Predicted)
storage temp.  2-8°C
pka 3.43±0.10(Predicted)
form  solid
InChI 1S/C7H9NO3/c1-4(2)6-3-5(7(9)10)8-11-6/h3-4H,1-2H3,(H,9,10)
InChIKey AYWGKTMGWXRLRO-UHFFFAOYSA-N
SMILES CC(C)c1cc(no1)C(O)=O

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
PPE Eyeshields, Gloves, type N95 (US)
Safety Statements  22-24/25
WGK Germany  3
HazardClass  IRRITANT
HS Code  2934999090
Storage Class 11 - Combustible Solids

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