Benzyl D-Glucuronate
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Benzyl D-Glucuronate
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CAS No:
135970-30-8
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Formula:
C13H16O7
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Chemical Name:
Benzyl D-Glucuronate
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Synonyms:
Benzyl D-Glucuronate;(2S,3S,4S,5R)-benzyl 3,4,5,6-tetrahydroxytetrahydro-2H-pyran-2-carboxylate;135970-30-8;SCHEMBL19458340;BENZYL (2S,3S,4S,5R)-3,4,5,6-TETRAHYDROXYOXANE-2-CARBOXYLATE
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CAS No:
Characteristics
116
1.442±0.06 g/cm3(Predicted)
104-108°C
566.5±50.0 °C(Predicted)
-20°C Freezer, Under Inert Atmosphere
Benzyl D-Glucuronate Use and Manufacturing
Used in efficient synthesis of 1β-O-acyl glucuronides via regioselective acylation
Computed Properties
Molecular Weight:284.26
XLogP3:-0.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:284.08960285
Monoisotopic Mass:284.08960285
Topological Polar Surface Area:116
Heavy Atom Count:20
Complexity:329
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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