2-(4-Methoxyphenyl)-5-Benzothiazoleacetic Acid Ethyl Ester
[CAS# 49702-17-2]

Identification

• Name: 2-(4-Methoxyphenyl)-5-Benzothiazoleacetic Acid Ethyl Ester
• Synonyms: 2-[2-(4-Methoxyphenyl)-1,3-Benzothiazol-5-Yl]Acetic Acid Ethyl Ester; Ethyl 2-[2-(4-Methoxyphenyl)-1,3-Benzothiazol-5-Yl]Ethanoate; 5-Benzothiazoleacetic Acid, 2-(4-Methoxyphenyl)-, Ethyl Ester
• Molecular Formula: C₁₈H₁₇NO₃S
• Molecular Weight: 327.40
• CAS Registry Number: 49702-17-2
• SMILES: C1=C(C=CC2=C1N=C(S2)C3=CC=C(C=C3)OC)CC(OCC)=O
• InChI: 1S/C18H17NO3S/c1-3-22-17(20)11-12-4-9-16-15(10-12)19-18(23-16)13-5-7-14(21-2)8-6-13/h4-10H,3,11H2,1-2H3
• InChIKey: RGIKAFNNDOGWCB-UHFFFAOYSA-N

Properties

• Density: 1.236g/cm³ (Cal.)
• Boiling point: 475.101°C at 760 mmHg (Cal.)
• Flash point: 241.133°C (Cal.)