5-Bromo-1-Methyl-3-Phenylbenzimidazol-2-One
[CAS# 79759-43-6]

Identification

• Name: 5-Bromo-1-Methyl-3-Phenylbenzimidazol-2-One
• Synonyms: 5-Bromo-1-Methyl-3-Phenyl-Benzimidazol-2-One; 5-Bromo-1-Methyl-3-Phenyl-2-Benzimidazolone; 1,3-Dihydro-5-Bromo-1-Methyl-3-Phenyl-2H-Benzimidazol-2-One
• Molecular Formula: C₁₄H₁₁BrN₂O
• Molecular Weight: 303.16
• CAS Registry Number: 79759-43-6
• SMILES: C2=C1N(C(N(C1=CC=C2Br)C)=O)C3=CC=CC=C3
• InChI: 1S/C14H11BrN2O/c1-16-12-8-7-10(15)9-13(12)17(14(16)18)11-5-3-2-4-6-11/h2-9H,1H3
• InChIKey: HRKLHPWXQWEIQA-UHFFFAOYSA-N

Properties

• Density: 1.535g/cm³ (Cal.)
• Boiling point: 419.653°C at 760 mmHg (Cal.)
• Flash point: 207.599°C (Cal.)