Basic information
- Standard SMILES
CC(C)CNc1nc(NCC(C)C)nc(C(Cl)(Cl)Cl)n1- InChIKey
BBEBKTUOHZOFNM-UHFFFAOYSA-N- Molecular formula
- C12H20Cl3N5
- Average molar mass
- 340.7 g/mol
- Monoisotopic mass
- 339.078429
Names & identifiers
- Preferred name
- 2-N,4-N-bis(2-methylpropyl)-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
- IUPAC
- 2-N,4-N-bis(2-methylpropyl)-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
Database identifiers
- PubChem CID
- 33481
- Nikkaji
- J1.611.378F
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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