[1]Benzothieno[2,3-b]pyridine 9,9-dioxide
Basic information
- CAS
37049-42-6- Standard SMILES
O=S1(=O)c2ccccc2-c2cccnc21- InChIKey
MLJJDVMKADUDDN-UHFFFAOYSA-N- Molecular formula
- C11H7NO2S
- Average molar mass
- 217.25 g/mol
- Monoisotopic mass
- 217.01974964
Names & identifiers
- Preferred name
- [1]Benzothieno[2,3-b]pyridine 9,9-dioxide
- IUPAC
- [1]benzothiolo[2,3-b]pyridine 9,9-dioxide
Names & synonyms
37049-42-6[1]benzothieno[2,3-b]pyridine 9,9-dioxideNSC152389DTXSID30302645NSC-1523899H-9lambda~6~-[1]Benzothieno[2,3-b]pyridine-9,9-dione
Database identifiers
- CAS
37049-42-6- PubChem CID
- 289922
- DTXSID
DTXSID30302645
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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