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Cryptochlorogenic acid Structure

Cryptochlorogenic acid

Chemical Properties

Boiling point 694.9±55.0 °C(Predicted)
Density  1.65
storage temp.  2-8°C
solubility  DMSO : 50 mg/mL (141.12 mM; Need ultrasonic)
pka 4.07±0.50(Predicted)
form  Solid
color  White-pale yellow
optical activity [α]/D -76.0±5.0°, c = 0.5 in H2O
Stability Hygroscopic
Major Application food and beverages
InChI InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-14-11(19)6-16(24,15(22)23)7-12(14)20/h1-5,11-12,14,17-20,24H,6-7H2,(H,22,23)/t11-,12-,14-,16+/m1/s1
InChIKey GYFFKZTYYAFCTR-NCZKRNLISA-N
SMILES O([C@H]1[C@@H](C[C@](C[C@H]1O)(O)C(=O)O)O)C(=O)C=CC1C=CC(=C(C=1)O)O

Safety Information

WGK Germany  3
Storage Class 11 - Combustible Solids

Usage And Synthesis

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