110241-35-5
110241-35-5 structure
- Name: 3-caffeoyl-4-sinapoylquinic acid
- Chemical Name: (1S,3S,4S,5S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
- CAS Number: 110241-35-5
- Molecular Formula: C27H28O13
- Molecular Weight: 560.50300
- Create Date: 2016-04-24 12:19:51
- Modify Date: 2023-01-15 16:49:31
| Name | (1S,3S,4S,5S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid |
|---|---|
| Synonyms |
3-Csqa
3-Caffeoyl-4-sinapoylquinic acid Cyclohexanecarboxylic acid,3-((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-1,5-dihydroxy-4-((3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propenyl)oxy)-,(1S-(1alpha,3beta(E),4alpha(E),5alpha)) 3-O-caffeoyl-4-O-sinapoylquinic acid |
| Density | 1.55g/cm3 |
|---|---|
| Boiling Point | 801.5ºC at 760mmHg |
| Molecular Formula | C27H28O13 |
| Molecular Weight | 560.50300 |
| Flash Point | 265.2ºC |
| Exact Mass | 560.15300 |
| PSA | 209.51000 |
| LogP | 1.34120 |
| Vapour Pressure | 4.14E-27mmHg at 25°C |
| Index of Refraction | 1.673 |