Basic information
- CAS
67130-27-2- Standard SMILES
CCc1nc2ccccc2c(=S)s1- InChIKey
MFEWANFLNVTJGO-UHFFFAOYSA-N- Molecular formula
- C10H9NS2
- Average molar mass
- 207.3 g/mol
- Monoisotopic mass
- 207.01764164
Names & identifiers
- Preferred name
- 4H-3,1-Benzothiazine-4-thione, 2-ethyl-
- IUPAC
- 2-ethyl-3,1-benzothiazine-4-thione
Names & synonyms
67130-27-24H-3,1-Benzothiazine-4-thione, 2-ethyl-DTXSID004949652-Ethyl-4H-3,1-benzothiazine-4-thione
Database identifiers
- CAS
67130-27-2- PubChem CID
- 12373539
- DTXSID
DTXSID00494965
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 69.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…