3-Ethyl-5-Methoxy-2-Methylbenzothiazolium p-Toluenesulphonate
[CAS# 42379-68-0]

Identification

• Name: 3-Ethyl-5-Methoxy-2-Methylbenzothiazolium p-Toluenesulphonate
• Synonyms: 3-Ethyl-5-Methoxy-2-Methylbenzothiazolium P-Toluenesulfonate; 3-Ethyl-5-Methoxy-2-Methylbenzothiazolium P-Toluenesulphonate; Benzothiazolium, 3-Ethyl-5-Methoxy-2-Methyl-, Salt With 4-Methylbenzenesulfonic Acid (1:1)
• Molecular Formula: C₁₈H₂₁NO₄S₂
• Molecular Weight: 379.49
• CAS Registry Number: 42379-68-0
• EINECS: 255-788-0
• SMILES: C2=C1[N+](=C(SC1=CC=C2OC)C)CC.C3=C([S]([O-])(=O)=O)C=CC(=C3)C
• InChI: 1S/C11H14NOS.C7H8O3S/c1-4-12-8(2)14-11-6-5-9(13-3)7-10(11)12;1-6-2-4-7(5-3-6)11(8,9)10/h5-7H,4H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
• InChIKey: RAPZVIBWDBUCCW-UHFFFAOYSA-M