Thiobis[2-tert-butyl-5-methyl-4,1-phenylene] 3-(laurylthio)propionate

Base Information

• Chemical Name: Thiobis[2-tert-butyl-5-methyl-4,1-phenylene] 3-(laurylthio)propionate
• CAS No.: 66534-05-2
• Deprecated CAS: 140401-00-9
• Molecular Formula: C52H86O4S3
• Molecular Weight: 871.4318
• European Community (EC) Number: 266-393-8
• DSSTox Substance ID: DTXSID3070464
• Nikkaji Number: J202.477B
• Wikidata: Q81997775
• Mol file: 66534-05-2.mol

Synonyms:66534-05-2;EINECS 266-393-8;Thiobis[2-tert-butyl-5-methyl-4,1-phenylene] 3-(laurylthio)propionate;Thiobis(2-tert-butyl-5-methyl-4,1-phenylene) 3-(laurylthio)propionate;Propanoic acid, 3-(dodecylthio)-, 1,1'-(thiobis(2-(1,1-dimethylethyl)-5-methyl-4,1-phenylene)) ester;Propanoic acid, 3-(dodecylthio)-, thiobis(2-(1,1-dimethylethyl)-5-methyl-4,1-phenylene) ester;Propanoic acid, 3-(dodecylthio)-, thiobis[2-(1,1-dimethylethyl)-5-methyl-4,1-phenylene] ester;SCHEMBL1984150;DTXSID3070464;C52H86O4S3;C52-H86-O4-S3;Thiobis(2-(1,1-dimethylethyl)-5-methyl-4,1-phenylene) bis(3-(dodecylthio)propionate);Bis[2-methyl-4-[3-(dodecylthio)propionyloxy]-5-tert-butylphenyl] sulfide;thiobis[2-(1,1-dimethylethyl)-5-methyl-4,1-phenylene]bis[3-(dodecylthio)propionate]

Chemical Property of Thiobis[2-tert-butyl-5-methyl-4,1-phenylene] 3-(laurylthio)propionate

Chemical Property:

• Vapor Pressure: 6.3E-29mmHg at 25°C
• Boiling Point: 846.6°Cat760mmHg
• Flash Point: 403.4°C
• Density: 1.03g/cm³
• XLogP3: 19.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 36
• Exact Mass: 870.56882474
• Heavy Atom Count: 59
• Complexity: 987

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCSCCC(=O)OC1=C(C=C(C(=C1)C)SC2=CC(=C(C=C2C)OC(=O)CCSCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C