Basic information
- CAS
30369-49-4- Standard SMILES
CCSc1nc(N)nc(C(Cl)(Cl)Cl)n1- InChIKey
LDHPFEKVDJNPKF-UHFFFAOYSA-N- Molecular formula
- C6H7Cl3N4S
- Average molar mass
- 273.6 g/mol
- Monoisotopic mass
- 271.9457
Names & identifiers
- Preferred name
- 4-Ethylsulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-ethylsulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
4-ethylsulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine30369-49-4DTXSID202752734-(ethylsulfanyl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
30369-49-4- PubChem CID
- 35265
- DTXSID
DTXSID20275273- Nikkaji
- J1.614.207G
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 90 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…