2-(2,4-dinitroanilino)-3-(1H-imidazol-5-yl)propanoic acid
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2-(2,4-dinitroanilino)-3-(1H-imidazol-5-yl)propanoic acid
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CAS No:
10457-26-8
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Formula:
C12H11N5O6
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Chemical Name:
2-(2,4-dinitroanilino)-3-(1H-imidazol-5-yl)propanoic acid
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Synonyms:
10457-26-8;NSC89979;N-dinitrophenyl-l-histidine;L-Histidine,4-dinitrophenyl)-;SCHEMBL7276715;NSC-89979;Nalpha-(2,4-dinitro-phenyl)-DL-histidine
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CAS No:
2-(2,4-dinitroanilino)-3-(1H-imidazol-5-yl)propanoic acid Basic Attributes
321.25 g/mol
321.07093309 g/mol
89979
Computed Properties
Molecular Weight:321.25
XLogP3:1.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:321.07093309
Monoisotopic Mass:321.07093309
Topological Polar Surface Area:170
Heavy Atom Count:23
Complexity:464
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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