Dibenzothiophene, 1,2,3,4-tetramethyl-
Basic information
- CAS
113547-12-9- Standard SMILES
Cc1c(C)c(C)c2c(sc3ccccc32)c1C- InChIKey
IDAGNSMSGNFFLD-UHFFFAOYSA-N- Molecular formula
- C16H16S
- Average molar mass
- 240.4 g/mol
- Monoisotopic mass
- 240.09727168
Names & identifiers
- Preferred name
- Dibenzothiophene, 1,2,3,4-tetramethyl-
- IUPAC
- 1,2,3,4-tetramethyldibenzothiophene
Names & synonyms
1,2,3,4-tetramethyldibenzothiopheneDibenzothiophene, 1,2,3,4-tetramethyl-113547-12-9DTXSID20150455RefChem:337259DTXCID4072946tetramethyl dibenzothiopheneSCHEMBL14825791,2,3,4-Tetramethyldibenzo[b,d]thiophene
Database identifiers
- CAS
113547-12-9- PubChem CID
- 86312
- DTXSID
DTXSID20150455
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 287
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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