basic_info |
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| Product_Name: | 1-BENZYL-4-[[4-[(HYDROXYBUTOXYL)CARBONYL]-BENZOYL]OXY]BUTYLBENZENEDICARBOXYLATE |
| CAS: | 66885-79-8 |
| EnglishSynonyms: | 1-BENZYL-4-[[4-[(HYDROXYBUTOXYL)CARBONYL]-BENZOYL]OXY]BUTYLBENZENEDICARBOXYLATE |
| pro_mdlNumber: | MFCD22417251 |
| pro_acceptors: | 8 |
| pro_donors: | 0 |
| pro_smile: | CCCCOC(=O)c1cccc(c1)C(=O)OCCCCOC(=O)c2ccc(cc2)C(=O)OCc3ccccc3 |
| InChi: | InChI=1S/C31H32O8/c1-2-3-18-36-30(34)26-12-9-13-27(21-26)31(35)38-20-8-7-19-37-28(32)24-14-16-25(17-15-24)29(33)39-22-23-10-5-4-6-11-23/h4-6,9-17,21H,2-3,7-8,18-20,22H2,1H3 |
| InChiKey: | InChIKey=SPHRJJDJIDZTHC-UHFFFAOYSA-N |
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