5-Isopropylisoxazole-3-carboxylic acid Structure

5-Isopropylisoxazole-3-carboxylic acid

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
UNSPSC Code 12352100
NACRES NA.22

Safety

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

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