4-Acetamidophenyl b-D-glucopyranosiduronic acid,methyl ester

Catalog Number

ACM570394171

Product Name

4-Acetamidophenyl b-D-glucopyranosiduronic acid,methyl ester

Structure

CAS

570394-17-1

Category

Heterocyclic Organic Compound

Synonyms

Acetaminophen Glucuronide Methyl Ester, 570394-17-1, 4-Acetamidophenyl beta-D-Glucuronic Acid Methyl Ester, AB15724, KB-36124, 4-Acetamidophenyl b-D-glucuronide methyl ester, 4-Acetamidophenyl |A-D-Glucuronic Acid Methyl Ester, 4-ACETAMIDOPHENYL BETA-D-GLUCURONIDE METHYL ESTER, 4-ACETAMIDOPHENYL B-D-GLUCURONIC ACID, METHYL ESTER, 4-(Acetylamino)phenyl |A-D-Glucopyranosiduronic Acid Methyl Ester, 4-(ACETYLAMINO)PHENYL BETA-D-GLUCOPYRANOSIDURONIC ACID METHYL ESTER

IUPAC Name

methyl (2S,3S,4S,5R,6S)-6-(4-acetamidophenoxy)-3,4,5-trihydroxyoxane-2-carboxylate

Molecular Weight

341.31326

Molecular Formula

C₁₅H₁₉NO₈

Canonical SMILES

CC(=O)NC1=CC=C(C=C1)OC2C(C(C(C(O2)C(=O)OC)O)O)O

InChI Key

PBCDFJAIFOUUBQ-DKBOKBLXSA-N

Boiling Point

607.173ºC at 760 mmHg

Melting Point

77ºC dec.

Flash Point

321.007ºC

Density

1.493g/cm³

Exact Mass

341.11100

H-Bond Acceptor

8

H-Bond Donor

4

MSDS

COA

Spec Sheet