Basic information
- CAS
18794-28-0- Standard SMILES
Cc1cccc(CSC(C)(C)C)n1- InChIKey
OBBGLTSIKZVHGI-UHFFFAOYSA-N- Molecular formula
- C11H17NS
- Average molar mass
- 195.33 g/mol
- Monoisotopic mass
- 195.10817072
Names & identifiers
- Preferred name
- Pyridine, 2-[(tert-butylthio)methyl]-6-methyl-
- IUPAC
- 2-(tert-butylsulfanylmethyl)-6-methylpyridine
- English name
- 2-Methyl-6-(tert-butylthiomethyl)pyridine
- Molecular weight
- 0
Names & synonyms
Pyridine, 2-[(tert-butylthio)methyl]-6-methyl-18794-28-02-(tert-butylsulfanylmethyl)-6-methylpyridine2-[(tert-Butylsulfanyl)methyl]-6-methylpyridineOBBGLTSIKZVHGI-UHFFFAOYSA-NDTXSID2013473002-(TERT-BUTYLMERCAPTO)-METHYL-6-PICOLINE2-[(tert-Butylsulfanyl)methyl]-6-methylpyridine #Q633982342-Methyl-6-(tert-butylthiomethyl)pyridine2-(tert-Butylthiomethyl)-6-methylpyridine6-Methyl-2-[(tert-butylthio)methyl]pyridine
Show more names
2-[(tert-Butylthio)methyl]-6-methylpyridine
Database identifiers
- CAS
18794-28-0- PubChem CID
- 587237
- DTXSID
DTXSID201347300- Nikkaji
- J46.478C
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 151
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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