4-Phenylimidazole , ≥98.0% , 670-95-1

CAS NO.：670-95-1

Empirical Formula: C9H8N2

Molecular Weight: 144.17

MDL number: MFCD00005197

EINECS: 211-580-1

PRODUCT 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)

Description and Uses

4-Phenylimidazole was used to investigate the protein-ligand interactions in cytochrome P450 from the thermoacidophile Picrophilus torridus. It was used as heme ligand during the crystallization of recombinant human indoleamine 2,3-dioxygenase. It was used in the synthesis of complexes of copper and cobalt.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• 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