4-(2-Methyl-2-propanyl)-1H-imidazole-5-carboxylic acid
[CAS# 714273-88-8]

Identification

• Name: 4-(2-Methyl-2-propanyl)-1H-imidazole-5-carboxylic acid
• Synonyms: 1H-IMIDAZOLE-5-CARBOXYLICACID, 4-(1,1-DIMETHYLETHYL)-; 5-(tert-butyl)-1H-imidazole-4-carboxylic acid; 5-tert-Butyl-1H-imidazole-4-carboxylic acid
• Molecular Formula: C₈H₁₂N₂O₂
• Molecular Weight: 168.19
• CAS Registry Number: 714273-88-8
• SMILES: CC(C)(C)c1ncnc1C(=O)O
• InChI: 1S/C8H12N2O2/c1-8(2,3)6-5(7(11)12)9-4-10-6/h4H,1-3H3,(H,9,10)(H,11,12)
• InChIKey: CHZBPWFTYFOPMN-UHFFFAOYSA-N

Properties

• Density: 1.2g/cm³ (Cal.)
• Melting point: 258-260°C (Expl.)
• Boiling point: 389.966°C at 760 mmHg (Cal.)
• Flash point: 189.645°C (Cal.)
• Refractive index: 1.542 (Cal.)

Safety Data

• Safety Description: IRRITANT