4-PHENYLIMIDAZOLE Structure

4-PHENYLIMIDAZOLE

Chemical Properties

Melting point 128-131 °C (lit.)
Boiling point 252.78°C (rough estimate)
Density  1.1357 (rough estimate)
refractive index  1.6200 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  acetone: soluble25mg/mL, clear, colorless to yellow (typical)
form  powder to crystal
pka 13.58±0.10(Predicted)
color  White to Orange to Green
BRN  2969
InChI InChI=1S/C9H8N2/c1-2-4-8(5-3-1)9-6-10-7-11-9/h1-7H,(H,10,11)
InChIKey XHLKOHSAWQPOFO-UHFFFAOYSA-N
SMILES C1NC(C2=CC=CC=C2)=CN=1
CAS DataBase Reference 670-95-1(CAS DataBase Reference)
FDA UNII 8VQ67XR7XY
UNSPSC Code 12352005
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36-24/25
WGK Germany  3
F  10
HS Code  29332900
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
0
1 0

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