5-[(4-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
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![5-[(4-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/1e6c49c7020e4cc4a269d4bfa962e3ab.png "5-[(4-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione")
5-[(4-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
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CAS No:
23536-26-7
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Formula:
C11H7N3O5
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Chemical Name:
5-[(4-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
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Synonyms:
NSC636616;23536-26-7;5-(4-Nitrobenzylidene)barbituric acid;CHEMBL404480;5-(4-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione;C11H7N3O5;DTXSID30320460;ZINC9329507;BDBM50375172;NSC359863;STK725171;AKOS001484961;MCULE-1278794541;NSC-359863;NSC-636616;ST012804;5-[(4-nitrophenyl)methylene]hexahydropyrimidine-2,4,6-trione;5-[(4-nitrophenyl)methylene]-1,3-dihydropyrimidine-2,4,6-trione;5-(4-(Hydroxy(oxido)amino)benzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione
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CAS No:
5-[(4-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione Basic Attributes
261.19 g/mol
261.03857033 g/mol
636616|359863
DTXSID30320460
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:261.19
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:261.03857033
Monoisotopic Mass:261.03857033
Topological Polar Surface Area:121
Heavy Atom Count:19
Complexity:449
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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