Benzoic acid,4-methoxy-, 7-oxo-1,3,5-cycloheptatrien-1-yl ester structure
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Common Name | Benzoic acid,4-methoxy-, 7-oxo-1,3,5-cycloheptatrien-1-yl ester | ||
|---|---|---|---|---|
| CAS Number | 2961-86-6 | Molecular Weight | 256.25300 | |
| Density | 1.25g/cm3 | Boiling Point | 443.8ºC at 760 mmHg | |
| Molecular Formula | C15H12O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 199.5ºC | |
| Name | 2-<4-Methoxy-benzoyloxy>-tropon |
|---|
| Density | 1.25g/cm3 |
|---|---|
| Boiling Point | 443.8ºC at 760 mmHg |
| Molecular Formula | C15H12O4 |
| Molecular Weight | 256.25300 |
| Flash Point | 199.5ºC |
| Exact Mass | 256.07400 |
| PSA | 52.60000 |
| LogP | 2.27460 |
| Vapour Pressure | 4.5E-08mmHg at 25°C |
| Index of Refraction | 1.594 |
| InChIKey | NSGMZXIILYRELI-UHFFFAOYSA-N |
| SMILES | COc1ccc(C(=O)Oc2cccccc2=O)cc1 |
|
~76%
Benzoic acid,4-... CAS#:2961-86-6 |
| Literature: Tamburlin-Thumin, Isabelle; Crozet, Michel P.; Barriere, Jean-Claude; Barreau, Michel; Riou, Jean-Francois; Lavelle, Francois European Journal of Medicinal Chemistry, 2001 , vol. 36, # 6 p. 561 - 568 |
| Precursor 2 | |
|---|---|
| DownStream 0 | |