basic_info |
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| Product_Name: | TRANS,TRANS-4'-PENTYL-BICYCLOHEXYL-4-CARBOXYLIC ACID 4-(TRANS-4-PROPYL-CYCLOHEXYL)-PHENYL ESTER |
| CAS: | 91545-93-6 |
| EnglishSynonyms: | TRANS,TRANS-4-(TRANS-4-PROPYLCYCLOHEXYL)-PHENYL 4'-PENTYLBICYCLOHEXYL-4-CARBOXYLATE ; TRANS,TRANS-4'-PENTYL-BICYCLOHEXYL-4-CARBOXYLIC ACID 4-(TRANS-4-PROPYL-CYCLOHEXYL)-PHENYL ESTER ; TRANS,TRANS-4-(TRANS-4-PROPYLCYCLOHEXYL)-PHENYL 4''-PENTYLBICYCLOHEXYL-4-CARBOXYLATE |
| pro_mdlNumber: | MFCD11053455 |
| pro_acceptors: | 2 |
| pro_donors: | 0 |
| pro_smile: | CCCCCC1CCC(CC1)[C@H]2CC[C@@H](CC2)C(=O)Oc3ccc(cc3)[C@H]4CC[C@@H](CC4)CCC |
| InChi: | InChI=1S/C33H52O2/c1-3-5-6-8-26-11-15-27(16-12-26)29-17-19-31(20-18-29)33(34)35-32-23-21-30(22-24-32)28-13-9-25(7-4-2)10-14-28/h21-29,31H,3-20H2,1-2H3/t25-,26?,27?,28-,29-,31- |
| InChiKey: | InChIKey=PMZQYNHDIQUXFG-OZLZHLKZSA-N |
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