AC1NKD39
5-(3,4-dichlorophenyl)-10-methyl-3,4,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
Also Known As: 3-(3,4-dichlorophenyl)-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidine|7-(3,4-dichlorophenyl)-3-methyl-6-hydropyrazolo[5,4-d]1,2,4-triazolo[4,3-e]pyr imidine
CAS: 879592-87-7
| Molecular Formula | C13H8Cl2N6 |
|---|---|
| Molecular Weight | 318.01874 g/mol |
| LogP | 2.9848 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.01874 |
| Monoisotopic Mass | 318.01874 |
| Heavy Atoms | 21 |
| Complexity | 987.0766 |
Chemical Identifiers
| CAS Number | 879592-87-7 |
|---|---|
| SMILES | CN1C2=C(C=N1)C3=NN=C(N3C=N2)C4=CC(=C(C=C4)Cl)Cl |
Product Overview
AC1NKD39 (CAS 879592-87-7), with molecular formula C13H8Cl2N6 and molecular weight 318.01874 g/mol. IUPAC: 5-(3,4-dichlorophenyl)-10-methyl-3,4,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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