CAS 778596-28-4

1,1-Dimethylethyl 33-mercapto-4,7,10,13,16,19,22,25,28,31-decaoxatritriacontanoate

Description:

1,1-Dimethylethyl 33-mercapto-4,7,10,13,16,19,22,25,28,31-decaoxatritriacontanoate, identified by its CAS number 778596-28-4, is a complex organic compound characterized by a long carbon chain and multiple functional groups. The presence of a mercapto group (-SH) indicates that it has thiol characteristics, which can impart unique reactivity, particularly in forming disulfide bonds or participating in redox reactions. The extensive decaoxatritriacontanoate structure suggests a high degree of molecular complexity, likely contributing to its physical properties such as solubility and melting point. The branched 1,1-dimethylethyl group may enhance steric hindrance, influencing the compound's reactivity and interaction with other molecules. This compound could have applications in various fields, including materials science and biochemistry, particularly in the development of surfactants or stabilizers due to its amphiphilic nature. However, specific applications and behavior would depend on further empirical studies and characterization.

Formula: C₂₇H₅₄O₁₂S

InChI: InChI=1S/C27H54O12S/c1-27(2,3)39-26(28)4-5-29-6-7-30-8-9-31-10-11-32-12-13-33-14-15-34-16-17-35-18-19-36-20-21-37-22-23-38-24-25-40/h40H,4-25H2,1-3H3

InChI key: InChIKey=JEWMRSWOXSDWIM-UHFFFAOYSA-N

SMILES: C(OCCOCCOCCOCCOCCOCCOCCOCCOCCS)COCCC(OC(C)(C)C)=O

Synonyms:

• 3,6,9,12,15,18,21,24,27,30-Decaoxatritriacontan-33-oic acid, 1-mercapto-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 33-mercapto-4,7,10,13,16,19,22,25,28,31-decaoxatritriacontanoate
• 4,7,10,13,16,19,22,25,28,31-Decaoxatritriacontanoic acid, 33-mercapto-, 1,1-dimethylethyl ester