basic_info |
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Product_Name: | 3-[(3-BROMOPHENYL)CARBONYL]PENTANENITRILE |
EnglishSynonyms: | 3-[(3-BROMOPHENYL)CARBONYL]PENTANENITRILE |
pro_mdlNumber: | MFCD16068086 |
pro_acceptors: | 2 |
pro_donors: | 0 |
pro_smile: | CCC(CC#N)C(=O)c1cccc(c1)Br |
InChi: | InChI=1S/C12H12BrNO/c1-2-9(6-7-14)12(15)10-4-3-5-11(13)8-10/h3-5,8-9H,2,6H2,1H3 |
InChiKey: | InChIKey=PAXWYUBZNUUYTH-UHFFFAOYSA-N |
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