2-[2-(4-Dimethylaminophenyl)-1,3-Benzothiazol-5-Yl]Acetic Acid
[CAS# 36774-73-9]

Identification

• Name: 2-[2-(4-Dimethylaminophenyl)-1,3-Benzothiazol-5-Yl]Acetic Acid
• Synonyms: 2-[2-(4-Dimethylaminophenyl)-1,3-Benzothiazol-5-Yl]Ethanoic Acid; 2-(4-Dimethylaminophenyl)-5-Benzothiazoleacetic Acid; 5-Benzothiazoleacetic Acid, 2-(4-Dimethylaminophenyl)-
• Molecular Formula: C₁₇H₁₆N₂O₂S
• Molecular Weight: 312.39
• CAS Registry Number: 36774-73-9
• SMILES: C1=C(C=CC2=C1N=C(S2)C3=CC=C(C=C3)N(C)C)CC(O)=O
• InChI: 1S/C17H16N2O2S/c1-19(2)13-6-4-12(5-7-13)17-18-14-9-11(10-16(20)21)3-8-15(14)22-17/h3-9H,10H2,1-2H3,(H,20,21)
• InChIKey: BIRDTWYHBGEPKA-UHFFFAOYSA-N

Properties

• Density: 1.318g/cm³ (Cal.)
• Boiling point: 529.486°C at 760 mmHg (Cal.)
• Flash point: 274.023°C (Cal.)