(3AR,4R,5R,6AS)-4-((E)-3,3-DIFLUORO-4-PHENOXYBUT-1-EN-1-YL)-2-OXOHEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL BENZOATE structure
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Common Name | (3AR,4R,5R,6AS)-4-((E)-3,3-DIFLUORO-4-PHENOXYBUT-1-EN-1-YL)-2-OXOHEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL BENZOATE | ||
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| CAS Number | 209861-00-7 | Molecular Weight | 428.425 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 588.3±50.0 °C at 760 mmHg | |
| Molecular Formula | C24H22F2O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 298.1±25.0 °C | |
| Name | [(3aR,4R,5R,6aS)-4-(3,3-difluoro-4-phenoxybut-1-enyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate |
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| Synonym | More Synonyms |
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 588.3±50.0 °C at 760 mmHg |
| Molecular Formula | C24H22F2O5 |
| Molecular Weight | 428.425 |
| Flash Point | 298.1±25.0 °C |
| Exact Mass | 428.143524 |
| PSA | 61.83000 |
| LogP | 4.29 |
| Vapour Pressure | 0.0±1.6 mmHg at 25°C |
| Index of Refraction | 1.579 |
| InChIKey | ZGAZCXXMVLTEHN-PFPAMLNPSA-N |
| SMILES | O=C1CC2C(CC(OC(=O)c3ccccc3)C2C=CC(F)(F)COc2ccccc2)O1 |
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~80%
(3AR,4R,5R,6AS)... CAS#:209861-00-7 |
| Literature: DR.REDDYS LABORATORIES LIMITED; JACKSON, Mark P Patent: WO2013/118058 A1, 2013 ; Location in patent: Page/Page column 8 ; |
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(3AR,4R,5R,6AS)... CAS#:209861-00-7 |
| Literature: DR.REDDYS LABORATORIES LIMITED; JACKSON, Mark P Patent: WO2013/118058 A1, 2013 ; |
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~%
(3AR,4R,5R,6AS)... CAS#:209861-00-7 |
| Literature: DR.REDDYS LABORATORIES LIMITED; JACKSON, Mark P Patent: WO2013/118058 A1, 2013 ; |
| (3aR,4R,5R,6aS)-4-[(1E)-3,3-Difluoro-4-phenoxy-1-buten-1-yl]-2-oxohexahydro-2H-cyclopenta[b]furan-5-yl benzoate |
| (1S,5R,6R,7R)-2-oxa-7-benzoyloxy-6-[(1E)-3,3-difluoro-4-phenoxy-1-butenyl]bicyclo[3.3.0]octan-3-one |
| (3aR,4R,5R,6aS)-4-((E)-3,3-difluoro-4-phenoxybut-1-en-1-yl)-2-oxohexahydro-2H-cyclopenta[b]furan-5-yl benzoate |
| 2H-Cyclopenta[b]furan-2-one, 5-(benzoyloxy)-4-[(1E)-3,3-difluoro-4-phenoxy-1-buten-1-yl]hexahydro-, (3aR,4R,5R,6aS)- |