4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol
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4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol
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CAS No:
97380-32-0
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Formula:
C13H18N2O6
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Chemical Name:
4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol
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Synonyms:
D-Chiro-inositol,1,5,6-trideoxy-5-(hydroxymethyl)-1-((4-nitrophenyl)amino)-,(5alpha); N-(4-Nitrophenyl)validamine; 4-(hydroxymethyl)-6-[(4-nitrophenyl)amino]cyclohexane-1,2,3-triol;
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CAS No:
4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol Basic Attributes
298.29200
298.11648630 g/mol
Computed Properties
Molecular Weight:298.29
XLogP3:0.2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:298.11648630
Monoisotopic Mass:298.11648630
Topological Polar Surface Area:139
Heavy Atom Count:21
Complexity:355
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol
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