4-(1-Methyl-1H-benzimidazol-2-yl)butanoic acid
[CAS# 802044-51-5]

Identification

• Name: 4-(1-Methyl-1H-benzimidazol-2-yl)butanoic acid
• Synonyms: 1H-BENZIMIDAZOLE-2-BUTANOICACID, 1-METHYL-; 4-(1-methyl-1H-benzo[d]imidazol-2-yl)butanoic acid; 4-(1-Methyl-1H-benzoimidazol-2-yl)-butyric acid
• Molecular Formula: C₁₂H₁₄N₂O₂
• Molecular Weight: 218.25
• CAS Registry Number: 802044-51-5
• SMILES: CN1C2=CC=CC=C2N=C1CCCC(=O)O
• InChI: 1S/C12H14N2O2/c1-14-10-6-3-2-5-9(10)13-11(14)7-4-8-12(15)16/h2-3,5-6H,4,7-8H2,1H3,(H,15,16)
• InChIKey: VBGYZHIJSIWBIT-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 459.6±28.0°C at 760 mmHg (Cal.)
• Flash point: 231.8±24.0°C (Cal.)
• Refractive index: 1.605 (Cal.)

Safety Data

• Safety Description: IRRITANT