basic_info |
|
| Product_Name： | 1-PYRENEBUTANOIC ACID METHYL ESTER |
| CAS： | 70570-29-5 |
| EnglishSynonyms： | 1-PYRENEBUTANOIC ACID METHYL ESTER |
| pro_mdlNumber： | MFCD01073705 |
| pro_acceptors： | 2 |
| pro_donors： | 0 |
| pro_smile： | COC(=O)CCCc1ccc2ccc3cccc4c3c2c1cc4 |
| InChi： | InChI=1S/C21H18O2/c1-23-19(22)7-3-4-14-8-9-17-11-10-15-5-2-6-16-12-13-18(14)21(17)20(15)16/h2,5-6,8-13H,3-4,7H2,1H3 |
| InChiKey： | InChIKey=IFGBWZMAYOBIGC-UHFFFAOYSA-N |
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