5-O-(3,4-Dihydroxycinnamoyl)-L-chinasure
Bezeichnung:5-O-(3,4-Dihydroxycinnamoyl)-L-chinasure
CAS-Nr327-97-9
Englisch Name:Chlorogenic acid
CBNumberCB2478906
SummenformelC16H18O9
Molgewicht354.31
MOL-Datei327-97-9.mol
Synonyma
5-O-(3,4-Dihydroxycinnamoyl)-L-chinasure
5-O-(3,4-Dihydroxycinnamoyl)-L-chinasure physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 210 °C (dec.) (lit.) |
| alpha | -36 º (c=1, H2O) |
| Siedepunkt | 407.55°C (rough estimate) |
| Dichte | 1.3594 (rough estimate) |
| Brechungsindex | -37 ° (C=1, H2O) |
| storage temp. | 2-8°C |
| Löslichkeit | Soluble in ethanol and acetone. |
| pka | 3.91±0.50(Predicted) |
| Aggregatzustand | Powder, Crystals, Needles and/or Chunks |
| Farbe | White to almost white |
| Wasserlöslichkeit | SOLUBLE IN HOT WATER |
| Merck | 14,2142 |
| InChIKey | CWVRJTMFETXNAD-JUHZACGLSA-N |
| LogP | -0.356 (est) |
| CAS Datenbank | 327-97-9(CAS DataBase Reference) |
| EPA chemische Informationen | Chlorogenic acid (327-97-9) |
| Kennzeichnung gefährlicher | Xi |
| R-Sätze: | 68 |
| S-Sätze: | 24/25 |
| WGK Germany | 3 |
| RTECS-Nr. | GU8480000 |
| Hazard Note | Irritant |
| HS Code | 29182900 |
| Toxizität | LDLo intraperitoneal in rat: 4gm/kg |
