1,3,5-Triazin-2-amine, N-propyl-4,6-bis(trichloromethyl)-
Basic information
- CAS
24803-30-3- Standard SMILES
CCCNc1nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n1- InChIKey
JQCCJRUGUGJQLU-UHFFFAOYSA-N- Molecular formula
- C8H8Cl6N4
- Average molar mass
- 372.9 g/mol
- Monoisotopic mass
- 369.888012
Names & identifiers
- Preferred name
- 1,3,5-Triazin-2-amine, N-propyl-4,6-bis(trichloromethyl)-
- IUPAC
- N-propyl-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
1,3,5-Triazin-2-amine, N-propyl-4,6-bis(trichloromethyl)-24803-30-3CHEMBL2286868SCHEMBL16298654DTXSID00879359SYMTRIAZINE24BISTRICHLOROMETHYL6PROPYLAMINON-Propyl-4,6-bis(trichloromethyl)-1,3,5-triazin-2(1H)-imine
Database identifiers
- CAS
24803-30-3- PubChem CID
- 32658
- DTXSID
DTXSID00879359- ChEMBL
CHEMBL2286868- Nikkaji
- J571.264E
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 243
Experimental & physicochemical properties
LogP4.09
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Compound notes
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