β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]
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β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]
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CAS No:
102623-18-7
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Formula:
C21H23NO8
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Chemical Name:
β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate]
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Synonyms:
β-D-Glucopyranuronic acid,1-[2-[(2,3-dimethylphenyl)amino]benzoate];Mefenamic acid glucuronide
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CAS No:
β-D-Glucopyranuronic acid, 1-[2-[(2,3-dimethylphenyl)amino]benzoate] Basic Attributes
417.40900
417.41
OX5H10G1RG
Characteristics
145.55000
1.16900
1.47g/cm3
110-112ºC
664.6ºC at 760mmHg
355.8ºC
1.659
1.43E-18mmHg at 25°C
Computed Properties
Molecular Weight:417.4
XLogP3:2.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:417.14236669
Monoisotopic Mass:417.14236669
Topological Polar Surface Area:146
Heavy Atom Count:30
Complexity:616
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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