Basic information
- CAS
881409-79-6- Standard SMILES
CC(c1c[nH]c(=S)[nH]1)c1cccc(Cl)c1Cl- InChIKey
WEMMJHMFGPJIJO-UHFFFAOYSA-N- Molecular formula
- C11H10Cl2N2S
- Average molar mass
- 273.2 g/mol
- Monoisotopic mass
- 271.9941749
Names & identifiers
- Preferred name
- 4-[1-(2,3-Dichlorophenyl)ethyl]-1,3-dihydroimidazole-2-thione
- IUPAC
- 4-[1-(2,3-dichlorophenyl)ethyl]-1,3-dihydroimidazole-2-thione
Names & synonyms
4-[1-(2,3-dichlorophenyl)ethyl]-1,3-dihydroimidazole-2-thione881409-79-6SCHEMBL3418059DTXSID30469287WEMMJHMFGPJIJO-UHFFFAOYSA-N4-[1-(2,3-dichloro-phenyl)-ethyl]-1,3-dihydro-imidazole-2-thione4-[1-(2,3-Dichlorophenyl)ethyl]-1,3-dihydro-2H-imidazole-2-thione
Database identifiers
- CAS
881409-79-6- PubChem CID
- 11601506
- DTXSID
DTXSID30469287
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 56.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 319
Related reactions
1 records
Compound notes
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