Basic information
- CAS
250347-30-9- Standard SMILES
CCCCCCN1c2ccccc2Sc2cc(C=O)ccc21- InChIKey
KRPIJNSHTPIYCB-UHFFFAOYSA-N- Molecular formula
- C19H21NOS
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.13438547
Names & identifiers
- Preferred name
- 10-Hexyl-10H-phenothiazine-3-carbaldehyde
- IUPAC
- 10-hexylphenothiazine-3-carbaldehyde
Names & synonyms
10-Hexyl-10H-phenothiazine-3-carbaldehyde250347-30-9DTXSID10635241RefChem:235702DTXCID9058599210-HEXYLPHENOTHIAZINE-3-CARBALDEHYDE10H-Phenothiazine-3-carboxaldehyde, 10-hexyl-N-hexyl-3-formylphenothiazine
Database identifiers
- CAS
250347-30-9- PubChem CID
- 23627140
- DTXSID
DTXSID10635241- Nikkaji
- J1.181.280E
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…