2-(2-Propen-1-Ylthio)-1H-Benzimidazole-1-Aceticacid
[CAS# 312754-94-2]

Identification

• Name: 2-(2-Propen-1-Ylthio)-1H-Benzimidazole-1-Aceticacid
• Synonyms: 2-(2-Allylsulfanylbenzimidazol-1-Yl)Acetate; 2-[2-(Allylthio)-1-Benzimidazolyl]Acetate; 2-[2-(Allylthio)Benzimidazol-1-Yl]Acetate
• Molecular Formula: C₁₂H₁₁N₂O₂S
• Molecular Weight: 247.29
• CAS Registry Number: 312754-94-2
• SMILES: C1=CC=CC2=C1[N](C(=N2)SCC=C)CC([O-])=O
• InChI: 1S/C12H12N2O2S/c1-2-7-17-12-13-9-5-3-4-6-10(9)14(12)8-11(15)16/h2-6H,1,7-8H2,(H,15,16)/p-1
• InChIKey: KZYPKCRIFNXKTH-UHFFFAOYSA-M

Properties

• Boiling point: 456.788°C at 760 mmHg (Cal.)
• Flash point: 230.057°C (Cal.)