Cyclohexanecarboxylicacid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-,(1S,3R,4S,5R)-

Names

[ CAS No. ]:
534-61-2

[ Name ]:
Cyclohexanecarboxylicacid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-,(1S,3R,4S,5R)-

[Synonym ]:
neochlorogenic acid
5-caffeoylquinic acid
Isochlorogenic
3-caffeoylquinic acid
3-mono-O-caffeoylquinic acid
3-O-caffeoylquinic acid
caffeoylquinic acid

Chemical & Physical Properties

[ Density]:
1.65g/cm3

[ Boiling Point ]:
665ºC at 760mmHg

[ Molecular Formula ]:
C₁₆H₁₈O₉

[ Molecular Weight ]:
354.30900

[ Flash Point ]:
245.5ºC

[ Exact Mass ]:
354.09500

[ PSA ]:
164.75000

[ Index of Refraction ]:
1.69