54605-72-0

Name 1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE
CAS 54605-72-0
Molecular Formula C10H8N2O
MDL Number MFCD02179568
Molecular Weight 172.18
MOL File 54605-72-0.mol

Chemical Properties

Melting point  84-88 °C
Boiling point  312.7±15.0 °C(Predicted)
density  1.15±0.1 g/cm3(Predicted)
storage temp.  under inert gas (nitrogen or Argon) at 2–8 °C
solubility  soluble in Toluene
form  Solid
pka -2.57±0.10(Predicted)
color  Pale yellow
Sensitive  Moisture & Light Sensitive
Detection Methods HPLC
InChI InChI=1S/C10H8N2O/c13-8-9-6-11-12(7-9)10-4-2-1-3-5-10/h1-8H
InChIKey PHVRLPFVPVKYOI-UHFFFAOYSA-N
SMILES N1(C2=CC=CC=C2)C=C(C=O)C=N1
CAS DataBase Reference 54605-72-0(CAS DataBase Reference)
Storage Precautions Heat sensitive

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  29339900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

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