Basic information
- CAS
15367-50-7- Standard SMILES
CCOC(=S)SCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1- InChIKey
OJILBRJTCQPLCP-UHFFFAOYSA-N- Molecular formula
- C18H28O2S2
- Average molar mass
- 340.5 g/mol
- Monoisotopic mass
- 340.15307248
Names & identifiers
- Preferred name
- O-ethyl (3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanylmethanethioate
- IUPAC
- O-ethyl (3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanylmethanethioate
Names & synonyms
15367-50-7S-[(3,5-Di-tert-butyl-4-hydroxyphenyl)methyl] O-ethyl carbonodithioateO-ethyl (3,5-ditert-butyl-4-hydroxyphenyl)methylsulfanylmethanethioateNSC290912Oprea1_676297DTXSID20314999STK832501AKOS001586607NSC-290912SR-01000389751SR-01000389751-1S-(3,5-di-tert-butyl-4-hydroxybenzyl) O-ethyl carbonodithioate
Show more names
S-3,5-di-tert-butyl-4-hydroxybenzyl O-ethyl carbonodithioateCarbonodithioic acid,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methyl]O-ethyl ester
Database identifiers
- CAS
15367-50-7- PubChem CID
- 324697
- DTXSID
DTXSID20314999
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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