2,3-Dihydro-3-Methyl-2-Phenyl-5-Benzothiazoleacetic Acid
[CAS# 52321-51-4]

Identification

• Name: 2,3-Dihydro-3-Methyl-2-Phenyl-5-Benzothiazoleacetic Acid
• Synonyms: 2-(3-Methyl-2-Phenyl-2H-1,3-Benzothiazol-5-Yl)Ethanoic Acid; 3-Methyl-2-Phenyl-5-Benzothiazolineacetic Acid; 5-Benzothiazolineacetic Acid, 3-Methyl-2-Phenyl-
• Molecular Formula: C₁₆H₁₅NO₂S
• Molecular Weight: 285.36
• CAS Registry Number: 52321-51-4
• SMILES: C1=C(C=CC2=C1N(C(S2)C3=CC=CC=C3)C)CC(O)=O
• InChI: 1S/C16H15NO2S/c1-17-13-9-11(10-15(18)19)7-8-14(13)20-16(17)12-5-3-2-4-6-12/h2-9,16H,10H2,1H3,(H,18,19)
• InChIKey: OCGNHCSQAXMFEA-UHFFFAOYSA-N

Properties

• Density: 1.293g/cm³ (Cal.)
• Boiling point: 498.095°C at 760 mmHg (Cal.)
• Flash point: 255.039°C (Cal.)