Carbonotrithioic acid, bis(4-methylphenyl) ester
Basic information
- CAS
24455-28-5- Standard SMILES
Cc1ccc(SC(=S)Sc2ccc(C)cc2)cc1- InChIKey
ZQEQLPRJWBNGFN-UHFFFAOYSA-N- Molecular formula
- C15H14S3
- Average molar mass
- 290.5 g/mol
- Monoisotopic mass
- 290.02576397
Names & identifiers
- Preferred name
- Carbonotrithioic acid, bis(4-methylphenyl) ester
- IUPAC
- bis[(4-methylphenyl)sulfanyl]methanethione
Names & synonyms
NSC24073124455-28-5Carbonotrithioic acid, bis(4-methylphenyl) esterDTXSID70311256ZQEQLPRJWBNGFN-UHFFFAOYSA-NBis(4-methylphenyl) carbonotrithioateNSC-240731Trithiocarboxylic acid, di(4-methylphenyl) ester
Database identifiers
- CAS
24455-28-5- PubChem CID
- 315484
- DTXSID
DTXSID70311256- Nikkaji
- J2.761.543K
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 82.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 235
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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