AC1O79FL
(2S,3R,10bS)-3-acetyl-2-(2,3-difluorophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile
Also Known As: (2S,3R,10bS)-3-acetyl-2-(2,3-difluorophenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile|(2S,3R,10bS)-3-acetyl-2-(2,3-difluorophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile
CAS: 305375-53-5
| Molecular Formula | C22H15F2N3O |
|---|---|
| Molecular Weight | 375.11832 g/mol |
| LogP | 4.08076 |
| Topological Polar Surface Area | 67.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.11832 |
| Monoisotopic Mass | 375.11832 |
| Heavy Atoms | 28 |
| Complexity | 1081.6912 |
Chemical Identifiers
| CAS Number | 305375-53-5 |
|---|---|
| SMILES | CC(=O)[C@H]1[C@@H](C([C@H]2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=C(C(=CC=C4)F)F |
Product Overview
AC1O79FL (CAS 305375-53-5), with molecular formula C22H15F2N3O and molecular weight 375.11832 g/mol. IUPAC: (2S,3R,10bS)-3-acetyl-2-(2,3-difluorophenyl)-3,10b-dihydro-2H-pyrrolo[2,1-a]isoquinoline-1,1-dicarbonitrile.
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.
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