Basic information
- CAS
24477-99-4- Standard SMILES
Cc1ccccc1Sc1nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n1- InChIKey
LVSSYTXFZGKVCU-UHFFFAOYSA-N- Molecular formula
- C12H7Cl6N3S
- Average molar mass
- 438 g/mol
- Monoisotopic mass
- 434.849185
Names & identifiers
- Preferred name
- 2-(2-Methylphenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine
- IUPAC
- 2-(2-methylphenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine
Names & synonyms
2-(2-methylphenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine24477-99-4DTXSID602749472-[(2-methylphenyl)sulfanyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
Database identifiers
- CAS
24477-99-4- PubChem CID
- 32417
- DTXSID
DTXSID60274947- Nikkaji
- J1.611.152J
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 64 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 353
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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