(2S)-2-(4-nitro-1,3-dioxoisoindol-2-yl)propanoic acid
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(2S)-2-(4-nitro-1,3-dioxoisoindol-2-yl)propanoic acid
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CAS No:
76582-11-1
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Formula:
C11H8N2O6
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Chemical Name:
(2S)-2-(4-nitro-1,3-dioxoisoindol-2-yl)propanoic acid
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Synonyms:
N-(3-nitrophthaloyl)alanine;ZINC2454790;EN300-87556;(2S)-2-(4-Nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanoic acid;76582-11-1
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CAS No:
(2S)-2-(4-nitro-1,3-dioxoisoindol-2-yl)propanoic acid Basic Attributes
264.19 g/mol
264.03823598 g/mol
Computed Properties
Molecular Weight:264.19
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:264.03823598
Monoisotopic Mass:264.03823598
Topological Polar Surface Area:121
Heavy Atom Count:19
Complexity:457
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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