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CAS 12769-22-1

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Phenol, 2,2′-[cyclohexylidenebis[(2-methyl-4,1-phenylene)azo]]bis[4-(1,1-dimethylethyl)-

Description:
Phenol, 2,2′-[cyclohexylidenebis[(2-methyl-4,1-phenylene)azo]]bis[4-(1,1-dimethylethyl)-, commonly referred to by its CAS number 12769-22-1, is a complex organic compound characterized by its azo dye structure. This substance features a phenolic backbone with multiple substituents, including cyclohexylidene and tert-butyl groups, which contribute to its unique chemical properties. The azo linkage (-N=N-) is significant as it imparts color and is commonly found in dyes and pigments. The presence of bulky tert-butyl groups enhances its solubility and stability, making it suitable for various applications, including as a dye in textiles and plastics. Additionally, the compound's structure suggests potential for strong intermolecular interactions, which can influence its thermal and optical properties. Overall, this compound exemplifies the intricate relationship between molecular structure and functionality in organic chemistry, particularly in the context of dye chemistry and material science.
Formula:C40H48N4O2
InChI:InChI=1S/C40H48N4O2/c1-26-22-30(12-16-32(26)41-43-34-24-28(38(3,4)5)14-18-36(34)45)40(20-10-9-11-21-40)31-13-17-33(27(2)23-31)42-44-35-25-29(39(6,7)8)15-19-37(35)46/h12-19,22-25,45-46H,9-11,20-21H2,1-8H3
InChI key:InChIKey=GDGMMJXIBFGSIP-UHFFFAOYSA-N
SMILES:CC=1C=C(C2(CCCCC2)C3=CC(C)=C(N=NC4=CC(C(C)(C)C)=CC=C4O)C=C3)C=CC1N=NC5=CC(C(C)(C)C)=CC=C5O
Synonyms:
  • Fat Yellow SG
  • Phenol, 2,2′-[cyclohexylidenebis[(2-methyl-4,1-phenylene)azo]]bis[4-(1,1-dimethylethyl)-
  • C.I. Solvent Yellow 31
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