Basic information
- CAS
31785-00-9- Standard SMILES
Cl.ClCCc1scnc1-c1ccc(Cl)cc1- InChIKey
PPGAQPKYWFHXDX-UHFFFAOYSA-N- Molecular formula
- C11H10Cl3NS
- Average molar mass
- 294.6 g/mol
- Monoisotopic mass
- 292.959954
Names & identifiers
- Preferred name
- Thiazole, 5-(2-chloroethyl)-4-(p-chlorophenyl)-, hydrochloride
- IUPAC
- 5-(2-chloroethyl)-4-(4-chlorophenyl)-1,3-thiazole;hydrochloride
Names & synonyms
31785-00-9Thiazole, 5-(2-chloroethyl)-4-(p-chlorophenyl)-, hydrochloride5-(2-Chloroethyl)-4-(4-chlorophenyl)thiazole hydrochloride5-(2-Chloroethyl)-4-(p-chlorophenyl)thiazole hydrochlorideDTXSID10185655RefChem:384588DTXCID501081465-(2-Chloroethyl)-4-(4-chlorophenyl)-1,3-thiazole--hydrogen chloride (1/1)
Database identifiers
- CAS
31785-00-9- PubChem CID
- 208201
- DTXSID
DTXSID10185655
Properties
Computed structural properties
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 195
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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