Basic information
- CAS
89580-84-7- Standard SMILES
CCNc1nc(N)nc(Cl)c1N- InChIKey
GJSBTOJJIMFVED-UHFFFAOYSA-N- Molecular formula
- C6H10ClN5
- Average molar mass
- 187.63 g/mol
- Monoisotopic mass
- 187.062473
Names & identifiers
- Preferred name
- 6-chloro-4-N-ethylpyrimidine-2,4,5-triamine
- IUPAC
- 6-chloro-4-N-ethylpyrimidine-2,4,5-triamine
Names & synonyms
89580-84-76-chloro-4-N-ethylpyrimidine-2,4,5-triamine6-chloro-N4-ethylpyrimidine-2,4,5-triamineNSC23907SCHEMBL13539690DTXSID90282030NSC-239076-Chloro-N~4~-ethylpyrimidine-2,4,5-triamineEN300-1653400
Database identifiers
- CAS
89580-84-7- PubChem CID
- 229863
- DTXSID
DTXSID90282030
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 89.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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