AC1NE87D
2-(3-chlorophenyl)-1-(3-methoxyphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
Also Known As: A3642/0154601|2-(3-chlorophenyl)-3-(3-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one|2-(3-chlorophenyl)-3-(3-methoxyphenyl)tetrahydropyrazolo[1,2-a][1,2,4]triazol-1(5H)-one|2-(3-chlorophenyl)-1-(3-methoxyphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
CAS: 697242-75-4
| Molecular Formula | C18H18ClN3O2 |
|---|---|
| Molecular Weight | 343.10876 g/mol |
| LogP | 3.9101 |
| Topological Polar Surface Area | 36.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.10876 |
| Monoisotopic Mass | 343.10876 |
| Heavy Atoms | 24 |
| Complexity | 782.36414 |
Chemical Identifiers
| CAS Number | 697242-75-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2N3CCCN3C(=O)N2C4=CC(=CC=C4)Cl |
Product Overview
AC1NE87D (CAS 697242-75-4), with molecular formula C18H18ClN3O2 and molecular weight 343.10876 g/mol. IUPAC: 2-(3-chlorophenyl)-1-(3-methoxyphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one.
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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