Basic information
- CAS
24802-86-6- Standard SMILES
CCCCCNc1nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n1- InChIKey
QQYVWADKUVVSAY-UHFFFAOYSA-N- Molecular formula
- C10H12Cl6N4
- Average molar mass
- 400.9 g/mol
- Monoisotopic mass
- 397.919313
Names & identifiers
- Preferred name
- N-pentyl-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine
- IUPAC
- N-pentyl-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amine
Names & synonyms
24802-86-6N-pentyl-4,6-bis(trichloromethyl)-1,3,5-triazin-2-amineCHEMBL2286870DTXSID20274968
Database identifiers
- CAS
24802-86-6- PubChem CID
- 32616
- DTXSID
DTXSID20274968- ChEMBL
CHEMBL2286870- Nikkaji
- J571.266A
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 270
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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