Introduction：Basic information about CAS 89130-86-9|Betulin 3-caffeate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Betulin 3-caffeate |
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| CAS Number | 89130-86-9 | Molecular Weight | 604.86 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 689.8±45.0 °C at 760 mmHg |
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| Molecular Formula | C39H56O5 | Melting Point | / |
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| MSDS | / | Flash Point | 205.2±22.2 °C |
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Names
| Name | Betulin caffeate |
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| Synonym | More Synonyms |
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Betulin 3-caffeate BiologicalActivity
| Description | Betulin caffeate (Betulin-3β-caffeate) is a triterpene caffeate compound[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| References | [1]. P. SARKAR, et al. Phytochemical Studies on the Stem Bark of Couroupita guianensis Aubl. Asian Journal of Chemistry; Vol. 25, No. 8 (2013), 4559-4562. |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 689.8±45.0 °C at 760 mmHg |
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| Molecular Formula | C39H56O5 |
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| Molecular Weight | 604.86 |
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| Flash Point | 205.2±22.2 °C |
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| Exact Mass | 604.412781 |
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| PSA | 86.99000 |
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| LogP | 10.92 |
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| Vapour Pressure | 0.0±2.3 mmHg at 25°C |
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| Index of Refraction | 1.571 |
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| InChIKey | VOQSZICWRNPAMF-IUGYEWCASA-N |
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| SMILES | C=C(C)C1CCC2(CO)CCC3(C)C(CCC4C5(C)CCC(OC(=O)C=Cc6ccc(O)c(O)c6)C(C)(C)C5CCC43C)C12 |
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Safety Information
Synonyms
| 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, (3β)-3-hydroxylup-20(29)-en-28-yl ester, (2E)- |
| (3β)-28-Hydroxylup-20(29)-en-3-yl (2E)-3-(3,4-dihydroxyphenyl)acrylate |
| Betulin 3-caffeate |
| (3β)-3-Hydroxylup-20(29)-en-28-yl (2E)-3-(3,4-dihydroxyphenyl)acrylate |
| 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, (3β)-28-hydroxylup-20(29)-en-3-yl ester, (2E)- |
