Basic information
- CAS
95617-11-1- Standard SMILES
CCOc1ccc(Oc2nc3ccc(Cl)cc3s2)cc1- InChIKey
FOGDPCUONLQSJP-UHFFFAOYSA-N- Molecular formula
- C15H12ClNO2S
- Average molar mass
- 305.8 g/mol
- Monoisotopic mass
- 305.0277275
Names & identifiers
- Preferred name
- 6-Chloro-2-(4-ethoxyphenoxy)-1,3-benzothiazole
- IUPAC
- 6-chloro-2-(4-ethoxyphenoxy)-1,3-benzothiazole
Names & synonyms
6-Chloro-2-(4-ethoxyphenoxy)-1,3-benzothiazole95617-11-1DTXSID10241902
Database identifiers
- CAS
95617-11-1- PubChem CID
- 178783
- DTXSID
DTXSID10241902
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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