Basic information
- CAS
672-93-5- Standard SMILES
CCc1nc(N)nc(Nc2ccc(Cl)cc2)n1- InChIKey
MQMYUDUHFVOMRQ-UHFFFAOYSA-N- Molecular formula
- C11H12ClN5
- Average molar mass
- 249.7 g/mol
- Monoisotopic mass
- 249.0781231
Names & identifiers
- Preferred name
- 2-(P-Chloroanilino)-4-ethyl-6-amino-1,3,5-triazine
- IUPAC
- 2-N-(4-chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamine
Names & synonyms
G055PV4GF9672-93-52-(P-CHLOROANILINO)-4-ETHYL-6-AMINO-1,3,5-TRIAZINEs-Triazine, 2-amino-4-(p-chloroanilino)-6-ethyl-2-Amino-4-(p-chloroanilino)-6-ethyl-S-triazine1,3,5-Triazine-2,4-diamine, N2-(4-chlorophenyl)-6-ethyl-2-N-(4-chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamineUNII-G055PV4GF9DTXSID10274513MQMYUDUHFVOMRQ-UHFFFAOYSA-NN~2~-(4-Chlorophenyl)-6-ethyl-1,3,5-triazine-2,4-diamine
Database identifiers
- CAS
672-93-5- PubChem CID
- 12652
- DTXSID
DTXSID10274513- UNII
- G055PV4GF9
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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