338982-11-9

Name 5-(4-CHLOROPHENYL)ISOXAZOLE-3-CARBOXYLIC ACID
CAS 338982-11-9
Molecular Formula C10H6ClNO3
MDL Number MFCD01935955
Molecular Weight 223.61
MOL File 338982-11-9.mol
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Chemical Properties

Melting point  185-186 °C
Boiling point  457.3±35.0 °C(Predicted)
density  1.440±0.06 g/cm3(Predicted)
storage temp.  Store at room temperature
form  solid
pka 2.14±0.10(Predicted)
Appearance White to off-white Solid
InChI 1S/C10H6ClNO3/c11-7-3-1-6(2-4-7)8-5-9(10(13)14)15-12-8/h1-5H,(H,13,14)
InChIKey COIATTMFFQMKKS-UHFFFAOYSA-N
SMILES O=C(O)C1=CC(C(C=C2)=CC=C2Cl)=NO1

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Spectrum Detail

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