dimethyl[?]dione
1,12-dimethyl-21-oxahexacyclo[10.6.5.02,11.03,8.013,18.019,23]tricosa-2(11),3,5,7,9,13,15,17-octaene-20,22-dione
Also Known As: dimethyl[?]dione|KST-1B8360|1,12-dimethyl-21-oxahexacyclo[10.6.5.02,11.03,8.013,18.019,23]tricosa-2(11),3,5,7,9,13,15,17-octaene-20,22-dione(non-preferred name)|1,12-Dimethyl-21-oxahexacyclo[10.6.5.0~2,11~.0~3,8~.0~13,18~.0~19,23~]tricosa-2,3,5,7,8,10,13,15,17-nonaene-20,22-dione|1,12-Dimethyl-21-oxahexacyclo[10.6.5.02,11.03,8.013,18.019,23]tricosa-2(11),3,5,7,9,13,15,17-octaene-20,22-dione
| Molecular Formula | C24H18O3 |
|---|---|
| Molecular Weight | 354.12558 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 354.12558 |
| Monoisotopic Mass | 354.12558 |
| Heavy Atoms | 27 |
| Complexity | 700.0 |
Chemical Identifiers
| CAS Number | 75464-10-7 |
|---|---|
| SMILES | CC12C3C(C(=O)OC3=O)C(C4=CC=CC=C41)(C5=C2C=CC6=CC=CC=C65)C |
| InChIKey | XSZWGOUULUZIQB-UHFFFAOYSA-N |
Product Overview
dimethyl[?]dione (CAS 75464-10-7), with molecular formula C24H18O3 and molecular weight 354.12558 g/mol. IUPAC: 1,12-dimethyl-21-oxahexacyclo[10.6.5.02,11.03,8.013,18.019,23]tricosa-2(11),3,5,7,9,13,15,17-octaene-20,22-dione.
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