(1S,2S)-2-(Dimethylamino)-1-(4-nitrophenyl)-1,3-propanediol
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(1S,2S)-2-(Dimethylamino)-1-(4-nitrophenyl)-1,3-propanediol
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CAS No:
18867-44-2
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Formula:
C11H16N2O4
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Chemical Name:
(1S,2S)-2-(Dimethylamino)-1-(4-nitrophenyl)-1,3-propanediol
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Synonyms:
1,3-Propanediol,2-(dimethylamino)-1-(4-nitrophenyl)-,(1S,2S)-;1,3-Propanediol,2-(dimethylamino)-1-(p-nitrophenyl)-,L-threo-(+)-;1,3-Propanediol,2-(dimethylamino)-1-(4-nitrophenyl)-,[S-(R*,R*)]-;(1S,2S)-2-(Dimethylamino)-1-(4-nitrophenyl)-1,3-propanediol;(1S,2S)-2-(N,N-Dimethylamino)-1-(p-nitrophenyl)-1,3-propanediol
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CAS No:
Computed Properties
Molecular Weight:240.26
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:240.11100700
Monoisotopic Mass:240.11100700
Topological Polar Surface Area:89.5
Heavy Atom Count:17
Complexity:246
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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