Molecular Structure:
CCD No.:CCD01090868
1-(2H-1,3-BENZODIOXOL-5-YL)PENTANE-1,3-DIONE
Formula:C12 H12 O4
MolWeight:220.223
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| Product Name： | 1-(2H-1,3-BENZODIOXOL-5-YL)PENTANE-1,3-DIONE |
| English Synonyms： | 1-(2H-1,3-BENZODIOXOL-5-YL)PENTANE-1,3-DIONE |
| MDL Number.： | MFCD11185246 |
| H bond acceptor： | 4 |
| H bond donor： | 0 |
| Smile： | CCC(=O)CC(=O)c1ccc2c(c1)OCO2 |
| InChi： | InChI=1S/C12H12O4/c1-2-9(13)6-10(14)8-3-4-11-12(5-8)16-7-15-11/h3-5H,2,6-7H2,1H3 |
| InChiKey： | InChIKey=ONTOMQNLQGUQSW-UHFFFAOYSA-N |
Basic Information
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