basic_info |
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| Product_Name: | 4-(1-CYANO-2-OXO-BUTYL)-BENZONITRILE |
| CAS: | 91973-34-1 |
| EnglishSynonyms: | BENZENEACETONITRILE, 4-CYANO-A-(1-OXOPROPYL)- ; 4-(1-CYANO-2-OXO-BUTYL)-BENZONITRILE ; 4-CYANO-A-(1-OXOPROPYL)-BENZENEACETONITRILE |
| pro_mdlNumber: | MFCD09031999 |
| pro_acceptors: | 3 |
| pro_donors: | 0 |
| pro_smile: | CCC(=O)C(C#N)c1ccc(cc1)C#N |
| InChi: | InChI=1S/C12H10N2O/c1-2-12(15)11(8-14)10-5-3-9(7-13)4-6-10/h3-6,11H,2H2,1H3 |
| InChiKey: | InChIKey=DEYRHVXROOCCEO-UHFFFAOYSA-N |
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