3-O-Caffeoylquinic acid methyl ester

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Names

[ Name ]:
3-O-Caffeoylquinic acid methyl ester

[Synonym ]:
Methyl (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylate
Chlorogenic acid methyl ester, Methyl (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylate
Methyl (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylate
E6GC3KV7JK
Methyl chlorogenate
Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-, methyl ester, (1S,3R,4R,5R)-

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
577.0±50.0 °C at 760 mmHg

[ Molecular Formula ]:
C₁₇H₂₀O₉

[ Molecular Weight ]:
368.335

[ Flash Point ]:
208.1±23.6 °C

[ Exact Mass ]:
368.110718

[ LogP ]:
0.31

[ Vapour Pressure ]:
0.0±1.7 mmHg at 25°C

[ Index of Refraction ]:
1.646

Related Compounds

3,4-Di-O-caffeoylquinic acid methyl ester
3,5-Di-O-caffeoylquinic acid methyl ester
4,5-Di-O-caffeoylquinic acid methyl ester
3-[o-[(Trimethylsilyl)oxy]phenyl]propenoic acid methyl ester
3-(o-N-Methylcarbamoyloxyphenyl)buttersaeuremethylester
3-O,4-O,5-O,6-O-Tetraacetyl-2-deoxy-D-arabino-hexonic acid methyl ester
2-(2-Methylphenyl)-1-phenylethan-1-amine
2-(1,2,3-Thiadiazol-4-yloxy)acetic acid
6-Methyl-6-aza-bicyclo[3.1.1]heptan-3-one
2-(naphthalen-1-yl)-N-(3-(3-(pyridin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)phenyl)acetamide
2-amino-6-fluoro-N-methylbenzamide
1,2,4-Triazolo[4,3-a]pyridine, 6-phenyl-
N-[(2,6-dichlorophenyl)methyl]hydroxylamine
2-Chloro-5-(3-methoxyphenyl)pyridine
N-(4-methoxynaphthalen-1-yl)-4-oxo-4H-chromene-2-carboxamide
2-Fluoro-4-(3-fluoro-4-methylphenyl)-1-methylbenzene