Basic information
- CAS
27470-68-4- Standard SMILES
CCCNc1nc(NC)nc(C(Cl)(Cl)Cl)n1- InChIKey
MZWZXJJFEWMPBY-UHFFFAOYSA-N- Molecular formula
- C8H12Cl3N5
- Average molar mass
- 284.6 g/mol
- Monoisotopic mass
- 283.015828
Names & identifiers
- Preferred name
- 4-N-methyl-2-N-propyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
- IUPAC
- 4-N-methyl-2-N-propyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
Names & synonyms
4-N-methyl-2-N-propyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine27470-68-4DTXSID70275081N~2~-Methyl-N~4~-propyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
27470-68-4- PubChem CID
- 33893
- DTXSID
DTXSID70275081- Nikkaji
- J1.612.248C
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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