basic_info |
|
| Product_Name： | 2-(3-BROMOPHENYL)-3-OXOHEPTANENITRILE |
| EnglishSynonyms： | 2-(3-BROMOPHENYL)-3-OXOHEPTANENITRILE |
| pro_mdlNumber： | MFCD12138974 |
| pro_acceptors： | 2 |
| pro_donors： | 0 |
| pro_smile： | CCCCC(=O)C(C#N)c1cccc(c1)Br |
| InChi： | InChI=1S/C13H14BrNO/c1-2-3-7-13(16)12(9-15)10-5-4-6-11(14)8-10/h4-6,8,12H,2-3,7H2,1H3 |
| InChiKey： | InChIKey=CMFRRNXWBNULKN-UHFFFAOYSA-N |
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