Basic information
- CAS
67643-08-7- Standard SMILES
S=C(Cc1cc(Cl)ccc1Cl)N1CCOCC1- InChIKey
INLKJJSLTUQSJV-UHFFFAOYSA-N- Molecular formula
- C12H13Cl2NOS
- Average molar mass
- 290.2 g/mol
- Monoisotopic mass
- 289.0094906
Names & identifiers
- Preferred name
- 2-(2,5-Dichlorophenyl)-1-(morpholin-4-yl)ethanethione
- IUPAC
- 2-(2,5-dichlorophenyl)-1-morpholin-4-ylethanethione
Names & synonyms
67643-08-72-(2,5-dichlorophenyl)-1-(morpholin-4-yl)ethanethioneNSC24139DTXSID20282083NSC-24139AKOS0052169132-(2,5-Dichlorophenyl)-1-(morpholin-4-yl)ethane-1-thione
Database identifiers
- CAS
67643-08-7- PubChem CID
- 229986
- DTXSID
DTXSID20282083
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 44.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…