basic_info |
|
| Product_Name： | B-CYANO-3-METHYL-A-OXO-BENZENEPROPANOIC ACID ETHYL ESTER |
| CAS： | 57248-93-8 |
| EnglishSynonyms： | BENZENEPROPANOIC ACID, B-CYANO-3-METHYL-A-OXO-, ETHYL ESTER ; B-CYANO-3-METHYL-A-OXO-BENZENEPROPANOIC ACID ETHYL ESTER |
| pro_mdlNumber： | MFCD16315719 |
| pro_acceptors： | 4 |
| pro_donors： | 0 |
| pro_smile： | CCOC(=O)C(=O)C(C#N)c1cccc(c1)C |
| InChi： | InChI=1S/C13H13NO3/c1-3-17-13(16)12(15)11(8-14)10-6-4-5-9(2)7-10/h4-7,11H,3H2,1-2H3 |
| InChiKey： | InChIKey=QSVGPFJLSVCAIR-UHFFFAOYSA-N |
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