Basic information
- CAS
58863-44-8- Standard SMILES
CSC(=S)c1c(C)cccc1C- InChIKey
PDMOWFAWWCDLCS-UHFFFAOYSA-N- Molecular formula
- C10H12S2
- Average molar mass
- 196.3 g/mol
- Monoisotopic mass
- 196.03804273
Names & identifiers
- Preferred name
- Methyl 2,6-dimethylbenzene-1-carbodithioate
- IUPAC
- methyl 2,6-dimethylbenzenecarbodithioate
Names & synonyms
58863-44-8NSC266596Methyl 2,6-dimethylbenzene-1-carbodithioateDTXSID50313157NSC-266596
Database identifiers
- CAS
58863-44-8- PubChem CID
- 320206
- DTXSID
DTXSID50313157
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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