4-[(3,4,5-trihydroxyoxan-2-yl)amino]benzoic acid
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![4-[(3,4,5-trihydroxyoxan-2-yl)amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/a3a1d69000614635bf7a6ec48df7b135.png "4-[(3,4,5-trihydroxyoxan-2-yl)amino]benzoic acid")
4-[(3,4,5-trihydroxyoxan-2-yl)amino]benzoic acid
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CAS No:
10396-71-1
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Formula:
C12H15NO6
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Chemical Name:
4-[(3,4,5-trihydroxyoxan-2-yl)amino]benzoic acid
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Synonyms:
N-p-Carboxyphenyl-D-xylosylamine;N-(4-carboxyphenyl)pentopyranosylamine;10396-71-1;CCRIS 1489;HMS3373M08;NSC20720;NSC 20720;NSC-20720;STK026946;AKOS001681739;MCULE-9209413839;SR-01000218132;SR-01000218132-1;BRD-A90642009-001-01-6
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CAS No:
4-[(3,4,5-trihydroxyoxan-2-yl)amino]benzoic acid Basic Attributes
269.25 g/mol
269.08993720 g/mol
20720
Computed Properties
Molecular Weight:269.25
XLogP3:-0.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:269.08993720
Monoisotopic Mass:269.08993720
Topological Polar Surface Area:119
Heavy Atom Count:19
Complexity:317
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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