5,6-Dimethyl-2-(3-(5,6-Dimethyl-3-Ethyl-2-Benzoxazolinylidene)-1-Propenyl)-3-Ethyl Benzoxazolium Iodide
[CAS# 52078-66-7]

Identification

• Name: 5,6-Dimethyl-2-(3-(5,6-Dimethyl-3-Ethyl-2-Benzoxazolinylidene)-1-Propenyl)-3-Ethyl Benzoxazolium Iodide
• Synonyms: 3-Ethyl-2-(3-(3-Ethyl-5,6-Dimethyl-3H-Benzoxazol-2-Ylidene)Prop-1-Enyl)-5,6-Dimethylbenzoxazolium Iodide; 5,6,5',6'-Tetramethyl-3,3'-Diethyl-2,2'-Oxacarbocyanine Iodide; Benzoxazolium, 3-Ethyl-2-(3-(3-Ethyl-5,6-Dimethyl-2(3H)-Benzoxazolylidene)-1-Propenyl)-5,6-Dimethyl-, Iodide
• Molecular Formula: C₂₅H₂₉IN₂O₂
• Molecular Weight: 516.42
• CAS Registry Number: 52078-66-7
• EINECS: 257-642-1
• SMILES: C1=C(C)C(=CC4=C1N(C(=C/C=CC2=[N+](C3=C(O2)C=C(C)C(=C3)C)CC)/O4)CC)C.[I-]
• InChI: 1S/C25H29N2O2.HI/c1-7-26-20-12-16(3)18(5)14-22(20)28-24(26)10-9-11-25-27(8-2)21-13-17(4)19(6)15-23(21)29-25;/h9-15H,7-8H2,1-6H3;1H/q+1;/p-1
• InChIKey: XFGPBUWHEYUAMX-UHFFFAOYSA-M