AC1MKBOZ
6-amino-8-(2-chloro-6-fluorophenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
Also Known As: Oprea1_465890|BAS 06899661|AK-777/11501121|6-amino-8-(2-chloro-6-fluorophenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile|SR-01000320562-1|6-amino-8-(2-chloro-6-fluorophenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile|6-amino-8-(6-chloro-2-fluorophenyl)-2-propyl-1,2,3,7,8,8a-hexahydroisoquinolin e-5,7,7-tricarbonitrile
CAS: 369404-19-3
| Molecular Formula | C21H19ClFN5 |
|---|---|
| Molecular Weight | 395.1313 g/mol |
| LogP | 3.61444 |
| Topological Polar Surface Area | 100.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.1313 |
| Monoisotopic Mass | 395.1313 |
| Heavy Atoms | 28 |
| Complexity | 957.26904 |
Chemical Identifiers
| CAS Number | 369404-19-3 |
|---|---|
| SMILES | CCCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=C(C=CC=C3Cl)F |
Product Overview
AC1MKBOZ (CAS 369404-19-3), with molecular formula C21H19ClFN5 and molecular weight 395.1313 g/mol. IUPAC: 6-amino-8-(2-chloro-6-fluorophenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile.
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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