basic_info |
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Product_Name: | 2-(2H-1,3-BENZODIOXOL-5-YL)-3-OXOBUTANENITRILE |
CAS: | 24966-30-1 |
EnglishSynonyms: | 1,3-BENZODIOXOLE-5-ACETONITRILE, A-ACETYL- ; 2-(2H-1,3-BENZODIOXOL-5-YL)-3-OXOBUTANENITRILE ; A-ACETYL-1,3-BENZODIOXOLE-5-ACETONITRILE |
pro_mdlNumber: | MFCD11208726 |
pro_acceptors: | 4 |
pro_donors: | 0 |
pro_smile: | CC(=O)C(C#N)c1ccc2c(c1)OCO2 |
InChi: | InChI=1S/C11H9NO3/c1-7(13)9(5-12)8-2-3-10-11(4-8)15-6-14-10/h2-4,9H,6H2,1H3 |
InChiKey: | InChIKey=PZRYREKIARPSKJ-UHFFFAOYSA-N |
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