4-Acetamidophenyl-2,3,4-tri-O-acetyl-b-D-glucuronide methyl ester

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Names

[ Name ]:
4-Acetamidophenyl-2,3,4-tri-O-acetyl-b-D-glucuronide methyl ester

[Synonym ]:
2-cyano-hexanoic acid methyl ester
2-Cyano-hexansaeuremethylester
Hexanoic acid,2-cyano-,methyl ester
Methyl-2-cyanohexanoate
methyl n-butylcyanoacetate

Chemical & Physical Properties

[ Density]:
1.345g/cm3

[ Boiling Point ]:
590.477ºC at 760 mmHg

[ Molecular Formula ]:
C₂₁H₂₅NO₁₁

[ Molecular Weight ]:
467.42300

[ Flash Point ]:
310.909ºC

[ Exact Mass ]:
467.14300

[ PSA ]:
152.76000

[ LogP ]:
0.78980

[ Index of Refraction ]:
1.538

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

4-Acetamidophenol
3,4,6-TRI-O-ACETYL-ALPHA-D-GLUCOPYRANOSE 1,2-(METHYL ORTHOACETATE)
(2S,3S,4S,5R,6S)-6-(4-aminophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
ketene
METHYL-((4-NITROPHENYL)-2,3,4-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSIDE)URONATE
diazomethane
Ethanoic anhydride
acetaminophen glucuronide
4-AMINOPHENYL 2,3,4-TRI-O-ACETYL-β-D-GLUCURONIDE METHYL ESTER