4-Pyrazolecarboxylic acid Structure

4-Pyrazolecarboxylic acid

Chemical Properties

Melting point 282 °C (dec.)(lit.)
Boiling point 417.1±18.0 °C(Predicted)
Density  1.524±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
form  Powder
pka 3.81±0.10(Predicted)
color  Off-white
InChI InChI=1S/C4H4N2O2/c7-4(8)3-1-5-6-2-3/h1-2H,(H,5,6)(H,7,8)
InChIKey IMBBXSASDSZJSX-UHFFFAOYSA-N
SMILES N1C=C(C(O)=O)C=N1
CAS DataBase Reference 37718-11-9(CAS DataBase Reference)
FDA UNII 4XJZ84GV8E
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-37/39
WGK Germany  3
HazardClass  IRRITANT
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
1
2 0

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