Basic information
- CAS
30369-47-2- Standard SMILES
CCCCCCCCCCCCNc1nc(SC)nc(C(Cl)(Cl)Cl)n1- InChIKey
ICDNITSTFHFRQQ-UHFFFAOYSA-N- Molecular formula
- C17H29Cl3N4S
- Average molar mass
- 427.9 g/mol
- Monoisotopic mass
- 426.117851
Names & identifiers
- Preferred name
- N-dodecyl-4-methylsulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- N-dodecyl-4-methylsulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
N-dodecyl-4-methylsulfanyl-6-(trichloromethyl)-1,3,5-triazin-2-amine30369-47-2DTXSID00275271N-dodecyl-4-(methylsulfanyl)-6-(trichloromethyl)-1,3,5-triazin-2-amine
Database identifiers
- CAS
30369-47-2- PubChem CID
- 35263
- DTXSID
DTXSID00275271- Nikkaji
- J1.614.205K
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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