Basic information
- CAS
27470-98-0- Standard SMILES
CCNc1nc(N)nc(C(Cl)(Cl)Cl)n1- InChIKey
RAUDVLOQTSPUMC-UHFFFAOYSA-N- Molecular formula
- C6H8Cl3N5
- Average molar mass
- 256.5 g/mol
- Monoisotopic mass
- 254.984528
Names & identifiers
- Preferred name
- 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
- IUPAC
- 2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
Names & synonyms
2-N-ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine27470-98-0DTXSID90275083N~2~-Ethyl-6-(trichloromethyl)-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
27470-98-0- PubChem CID
- 33898
- DTXSID
DTXSID90275083- Nikkaji
- J1.612.270J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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