basic_info |
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| Product_Name： | 3-OXO-1,8-OCTANEDICARBOXYLIC ACID |
| CAS： | 114212-45-2 |
| EnglishSynonyms： | 3-OXO-1,8-OCTANEDICARBOXYLIC ACID |
| pro_mdlNumber： | MFCD00154344 |
| pro_acceptors： | 5 |
| pro_donors： | 2 |
| pro_smile： | C(CCC(=O)CCC(=O)O)CCC(=O)O |
| InChi： | InChI=1S/C10H16O5/c11-8(6-7-10(14)15)4-2-1-3-5-9(12)13/h1-7H2,(H,12,13)(H,14,15) |
| InChiKey： | InChIKey=XTQIBFVBYWIHIP-UHFFFAOYSA-N |
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