D-Glucopyranuronic acid, methyl ester,2,3,4-triacetate-1-[2,2,2-trifluoro-N-(4-methoxyphenyl)ethanimidate]


Chemical Name: D-Glucopyranuronic acid, methyl ester,2,3,4-triacetate-1-[2,2,2-trifluoro-N-(4-methoxyphenyl)ethanimidate]
CAS Number: 918158-52-8
Product Number: AG00GX24(AGN-PC-0VW3II)
Synonyms:
MDL No:
Molecular Formula: C22H24F3NO11
Molecular Weight: 535.4212696

Identification/Properties


Computed Properties
Molecular Weight:
535.425g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
15
Rotatable Bond Count:
12
Exact Mass:
535.13g/mol
Monoisotopic Mass:
535.13g/mol
Topological Polar Surface Area:
145A^2
Heavy Atom Count:
37
Formal Charge:
0
Complexity:
870
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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