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CAS#: 77609-84-8 Product: 4-Cyclohexene-1,3-dione No suppilers available for the product. |
| Name | 4-Cyclohexene-1,3-dione |
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| Synonyms | 4-Cyclohexene-1,3-dione; meta-benzoquinone |
| Molecular Structure |  |
| Molecular Formula | C6H6O2 |
| Molecular Weight | 110.11 |
| CAS Registry Number | 77609-84-8 |
| SMILES | O=C1CC(=O)/C=C\C1 |
| InChI | 1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-2H,3-4H2 |
| InChIKey | JVXNCJLLOUQYBF-UHFFFAOYSA-N |
| Density | 1.187g/cm3 (Cal.) |
|---|---|
| Boiling point | 249.195°C at 760 mmHg (Cal.) |
| Flash point | 91.558°C (Cal.) |
| (1) | W. Carl Lineberger and Weston Thatcher Borden. The synergy between qualitative theory, quantitative calculations, and direct experiments in understanding, calculating, and measuring the energy differences between the lowest singlet and triplet states of organic diradicals, Phys. Chem. Chem. Phys., 2011, 13, 11792. |
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