D-Glucuronic acid, phenylmethyl ester


Chemical Name: D-Glucuronic acid, phenylmethyl ester
CAS Number: 135970-30-8
Product Number: AG00723P(AGN-PC-0O193H)
Synonyms:
MDL No:
Molecular Formula: C13H16O7
Molecular Weight: 284.2619

Identification/Properties


Computed Properties
Molecular Weight:
284.264g/mol
XLogP3:
-0.5
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
284.09g/mol
Monoisotopic Mass:
284.09g/mol
Topological Polar Surface Area:
116A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
329
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

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NMR Spectrum


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