3-(4-Chlorophenyl)-1lambda(4),2-dithiol-5-yl methyl sulfide
Basic information
- CAS
46298-98-0- Standard SMILES
CSc1cc(-c2ccc(Cl)cc2)s[s+]1- InChIKey
DGYVRGHHMNGXKB-UHFFFAOYSA-N- Molecular formula
- C10H8ClS3+
- Average molar mass
- 259.8 g/mol
- Monoisotopic mass
- 258.9476665
Names & identifiers
- Preferred name
- 3-(4-Chlorophenyl)-1lambda(4),2-dithiol-5-yl methyl sulfide
- IUPAC
- 3-(4-chlorophenyl)-5-methylsulfanyldithiol-1-ium
Names & synonyms
NSC 1970433-(4-Chlorophenyl)-1lambda(4),2-dithiol-5-yl methyl sulfide59704-70-0NSC197043Q6J7M23CPEDTXSID202084253-(4-chlorophenyl)-5-methylsulfanyl-dithiol-1-ium3-(4-Chlorophenyl)-5-(methylthio)-1,2-dithiol-1-ium1,2-Dithiol-1-ium, 3-(4-chlorophenyl)-5-(methylthio)-3-(4-Chlorophenyl)-5-(methylthio)-1.lambda.~4~,2-dithiole3-(4-Chlorophenyl)-1.lambda.~4~,2-dithiol-5-yl methyl sulfide(Z)-[5-(4-Chlorophenyl)-3H-1,2-dithiol-3-ylidene](methyl)sulfanium
Show more names
46298-98-0
Database identifiers
- CAS
46298-98-0、59704-70-0- PubChem CID
- 494170
- DTXSID
DTXSID20208425- UNII
- Q6J7M23CPE
Properties
Computed structural properties
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 1
- Complexity
- 180
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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