Introduction：Basic information about CAS 69956-77-0|Pelubiprofen, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pelubiprofen |
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| CAS Number | 69956-77-0 | Molecular Weight | 258.312 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 457.4±34.0 °C at 760 mmHg |
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| Molecular Formula | C16H18O3 | Melting Point | / |
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| MSDS | / | Flash Point | 244.5±22.2 °C |
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Names
| Name | 2-[4-[(E)-(2-oxocyclohexylidene)methyl]phenyl]propanoic acid |
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| Synonym | More Synonyms |
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Pelubiprofen BiologicalActivity
| Description | Pelubiprofen, an orally active and non-steroidal anti-inflammatory drug, is a member of the 2-arylpropionic acid family and has relatively selective effects on COX-2 activity. Pelubiprofen inhibits COX activity and the transforming growth factor-β activated kinase 1-IκB kinase β-NF-κB pathway, and has significant anti-inflammatory and analgesic effects[1]. |
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| Related Catalog | Signaling Pathways >>Immunology/Inflammation >>COX |
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| Target | COX-2 |
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| References | [1]. Choi IA, Baek HJ, et al. Comparison of the efficacy and safety profiles of a pelubiprofen versus celecoxib in patients with rheumatoid arthritis: a 6-week, multicenter, randomized, double-blind, phase III, non-inferiority clinical trial. BMC Musculoskelet Disord. 2014 Nov 18;15:375. |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 457.4±34.0 °C at 760 mmHg |
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| Molecular Formula | C16H18O3 |
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| Molecular Weight | 258.312 |
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| Flash Point | 244.5±22.2 °C |
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| Exact Mass | 258.125580 |
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| PSA | 54.37000 |
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| LogP | 2.76 |
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| Vapour Pressure | 0.0±1.2 mmHg at 25°C |
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| Index of Refraction | 1.605 |
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| InChIKey | AUZUGWXLBGZUPP-GXDHUFHOSA-N |
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| SMILES | CC(C(=O)O)c1ccc(C=C2CCCCC2=O)cc1 |
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Synonyms
| 2-[4-(2-oxo-1-cyclohexyliden methyl)-phenyl]propionic acid |
| Benzeneacetic acid, α-methyl-4-[(E)-(2-oxocyclohexylidene)methyl]- |
| 2-Ocmpp |
| 2-{4-[(E)-(2-Oxocyclohexylidene)methyl]phenyl}propanoic acid |
| (+/-)-2-[4-(2-Oxocyclohexylidenemethyl)phenyl]propionic acid |
| (±)-p-[[(E)-2-Oxocyclohexylidene]methyl]hydratropic Acid |
| Pelubiprofen |
| Pelubiprofen (JAN/INN) |
| 2-[4-(2-oxo-1-cyclohexylidenemethyl)phenyl]propionic acid |
| MFCD00870907 |
