5-Chloro-3-Ethyl-2-[(E)-(3,5,5-Trimethyl-2-Cyclohexen-1-Ylidene)Methyl]-1,3-Benzothiazol-3-Ium Iodide
[CAS# 124145-84-2]

Identification

• Name: 5-Chloro-3-Ethyl-2-[(E)-(3,5,5-Trimethyl-2-Cyclohexen-1-Ylidene)Methyl]-1,3-Benzothiazol-3-Ium Iodide
• Synonyms: 5-chloro-3-ethyl-2-[(E)-(3,5,5-trimethylcyclohex-2-en-1-ylidene)methyl]-1,3-benzothiazol-3-ium iodide; Benzothiazolium, 5-chloro-3-ethyl-2-[(3,5,5-trimethyl-2-cyclohexen-1-ylidene)methyl]- (9CI)
• Molecular Formula: C₁₉H₂₃ClINS
• Molecular Weight: 459.82
• CAS Registry Number: 124145-84-2
• SMILES: CC[n+]1c2cc(ccc2sc1C=C3CC(CC(=C3)C)(C)C)Cl.[I-]
• InChI: 1S/C19H23ClNS.HI/c1-5-21-16-10-15(20)6-7-17(16)22-18(21)9-14-8-13(2)11-19(3,4)12-14;/h6-10H,5,11-12H2,1-4H3;1H/q+1;/p-1/b14-9-
• InChIKey: AJWORWNRPYOKEX-WQRRWHLMSA-M

Properties

• Refractive index: (Cal.)