Introduction：Basic information about CAS 478336-92-4|ISO-1, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | ISO-1 |
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| CAS Number | 478336-92-4 | Molecular Weight | 235.236 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 365.0±48.0 °C at 760 mmHg |
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| Molecular Formula | C12H13NO4 | Melting Point | 114 °C |
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| MSDS | / | Flash Point | 174.6±29.6 °C |
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Names
| Name | methyl 2-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-oxazolidin-5-yl]acetate |
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| Synonym | More Synonyms |
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ISO-1 BiologicalActivity
| Description | ISO-1 is a macrophage migration inhibitory factor (MIF) antagonist with an IC50 of 7 μM. |
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| Related Catalog | Signaling Pathways >>Others >>OthersResearch Areas >>Inflammation/Immunology |
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| References | [1]. Lubetsky JB, et al. The tautomerase active site of macrophage migration inhibitory factor is a potential target for discovery of novel anti-inflammatory agents. J Biol Chem. 2002 Jul 12;277(28):24976-82. [2]. Al-Abed Y, et al. ISO-1 binding to the tautomerase active site of MIF inhibits its pro-inflammatory activity and increases survival in severe sepsis. J Biol Chem. 2005 Nov 4;280(44):36541-4. [3]. Nothnick WB, et al. Inhibition of macrophage migration inhibitory factor reduces endometriotic implant size in mice with experimentally induced disease. J Endometr. 2011 Sep 30;3(3):135-142. |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 365.0±48.0 °C at 760 mmHg |
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| Melting Point | 114 °C |
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| Molecular Formula | C12H13NO4 |
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| Molecular Weight | 235.236 |
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| Flash Point | 174.6±29.6 °C |
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| Exact Mass | 235.084457 |
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| PSA | 64.63000 |
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| LogP | 0.89 |
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| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
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| Index of Refraction | 1.582 |
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| InChIKey | AIXMJTYHQHQJLU-UHFFFAOYSA-N |
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| SMILES | COC(=O)CC1CC(c2ccc(O)cc2)=NO1 |
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Safety Information
Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| Methyl [3-(4-hydroxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetate |
| UNII-7QFF3Z0V9X |
| MIF Antagonist,ISO-1 |
| 5-Isoxazoleacetic acid, 4,5-dihydro-3-(4-hydroxyphenyl)-, methyl ester |
| 3-(4-HYDROXYPHENYL)-4,5-DIHYDRO-5-ISOXAZOLE-ACETIC ACID METHYL ESTER |
| 3-(4-hydroxyphenyl)-4,5-dihydro-5-isoxazoleacetic acid methyl ester |
| UNII:7QFF3Z0V9X |
| Macrophage Migration Inhibitory Factor Antagonist,ISO-1 |
| ISO-1 |
