basic_info |
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| Product_Name: | 1,3-DIHYDRO-3,3-DIMETHYL-1-OXO-5-ISOBENZOFURANCARBONITRILE |
| CAS: | 872617-39-5 |
| EnglishSynonyms: | 3,3-DIMETHYL-1-OXO-1,3-DIHYDRO-2-BENZOFURAN-5-CARBONITRILE ; 5-ISOBENZOFURANCARBONITRILE, 1,3-DIHYDRO-3,3-DIMETHYL-1-OXO- ; 1,3-DIHYDRO-3,3-DIMETHYL-1-OXO-5-ISOBENZOFURANCARBONITRILE |
| pro_mdlNumber: | MFCD13192307 |
| pro_acceptors: | 3 |
| pro_donors: | 0 |
| pro_smile: | CC1(c2cc(ccc2C(=O)O1)C#N)C |
| InChi: | InChI=1S/C11H9NO2/c1-11(2)9-5-7(6-12)3-4-8(9)10(13)14-11/h3-5H,1-2H3 |
| InChiKey: | InChIKey=YUOKMEHQZUMTPC-UHFFFAOYSA-N |
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