Basic information
- CAS
116406-13-4- Standard SMILES
CCCCCCCCCCc1nc2ccccc2s1- InChIKey
FWIRDJNVAUPONL-UHFFFAOYSA-N- Molecular formula
- C17H25NS
- Average molar mass
- 275.5 g/mol
- Monoisotopic mass
- 275.17077098
Names & identifiers
- Preferred name
- 2-Decyl-1,3-benzothiazole
- IUPAC
- 2-decyl-1,3-benzothiazole
Names & synonyms
116406-13-42-DECYL-1,3-BENZOTHIAZOLESCHEMBL27899648DTXSID90556905
Database identifiers
- CAS
116406-13-4- PubChem CID
- 14172012
- DTXSID
DTXSID90556905
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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