6-(Tert-butyl)-2-[3-(tert-butyl)-5-ethyl-2-hydroxyphenylthio]-4-ethylphenol
Basic information
- CAS
82100-95-6- Standard SMILES
CCc1cc(Sc2cc(CC)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1- InChIKey
WSBKIGXYPWZTJN-UHFFFAOYSA-N- Molecular formula
- C24H34O2S
- Average molar mass
- 386.6 g/mol
- Monoisotopic mass
- 386.2279515
Names & identifiers
- Preferred name
- 6-(Tert-butyl)-2-[3-(tert-butyl)-5-ethyl-2-hydroxyphenylthio]-4-ethylphenol
- IUPAC
- 2-tert-butyl-6-(3-tert-butyl-5-ethyl-2-hydroxyphenyl)sulfanyl-4-ethylphenol
Names & synonyms
SCHEMBL6131132DTXSID901232213AKOS02427999682100-95-6ST0292772,2'-Sulfanediylbis(6-tert-butyl-4-ethylphenol)2,2a(2)-Thiobis[6-(1,1-dimethylethyl)-4-ethylphenol]6-(tert-butyl)-2-[3-(tert-butyl)-5-ethyl-2-hydroxyphenylthio]-4-ethylphenol
Database identifiers
- CAS
82100-95-6- PubChem CID
- 3923312
- DTXSID
DTXSID901232213
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 65.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 422
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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