Betulin 3-caffeate structure
|
Common Name | Betulin 3-caffeate | ||
|---|---|---|---|---|
| CAS Number | 89130-86-9 | Molecular Weight | 604.86 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 689.8±45.0 °C at 760 mmHg | |
| Molecular Formula | C39H56O5 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 205.2±22.2 °C | |
Use of Betulin 3-caffeateBetulin caffeate (Betulin-3β-caffeate) is a triterpene caffeate compound[1]. |
| Name | Betulin caffeate |
|---|---|
| Synonym | More Synonyms |
| Description | Betulin caffeate (Betulin-3β-caffeate) is a triterpene caffeate compound[1]. |
|---|---|
| Related Catalog | |
| References |
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 689.8±45.0 °C at 760 mmHg |
| Molecular Formula | C39H56O5 |
| Molecular Weight | 604.86 |
| Flash Point | 205.2±22.2 °C |
| Exact Mass | 604.412781 |
| PSA | 86.99000 |
| LogP | 10.92 |
| Vapour Pressure | 0.0±2.3 mmHg at 25°C |
| Index of Refraction | 1.571 |
| InChIKey | VOQSZICWRNPAMF-IUGYEWCASA-N |
| 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 |
| Hazard Codes | Xi |
|---|
| 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)- |