N-(4-methylphenyl)-N-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]nitrous amide
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N-(4-methylphenyl)-N-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]nitrous amide
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CAS No:
111858-68-5
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Formula:
C13H18N2O6
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Chemical Name:
N-(4-methylphenyl)-N-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]nitrous amide
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Synonyms:
N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine;111858-68-5;CCRIS 3637;N-Nitroso-N-p-tolyl-D-fructopyranosylamine;D-Fructopyranosylamine, N-nitroso-N-p-tolyl-;DTXSID30920585;D-Fructopyranose, 1-deoxy-1-((4-methylphenyl)nitrosoamino)- (9CI);1-Deoxy-1-[(4-methylphenyl)(nitroso)amino]hex-2-ulopyranose
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CAS No:
N-(4-methylphenyl)-N-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]nitrous amide Basic Attributes
298.29 g/mol
298.11648630 g/mol
Computed Properties
Molecular Weight:298.29
XLogP3:-0.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:298.11648630
Monoisotopic Mass:298.11648630
Topological Polar Surface Area:123
Heavy Atom Count:21
Complexity:363
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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