Basic information
- CAS
30369-43-8- Standard SMILES
C=CCNc1nc(SC)nc(C(Cl)(Cl)Cl)n1- InChIKey
XGWCBKPLKJNVSE-UHFFFAOYSA-N- Molecular formula
- C8H9Cl3N4S
- Average molar mass
- 299.6 g/mol
- Monoisotopic mass
- 297.961351
Names & identifiers
- Preferred name
- 4-methylsulfanyl-N-prop-2-enyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- 4-methylsulfanyl-N-prop-2-enyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
4-methylsulfanyl-N-prop-2-enyl-6-(trichloromethyl)-1,3,5-triazin-2-amine30369-43-8DTXSID302752694-(methylsulfanyl)-N-(prop-2-en-1-yl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
30369-43-8- PubChem CID
- 35259
- DTXSID
DTXSID30275269- Nikkaji
- J1.614.201H
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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