[(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate
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![[(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/67ebb77be4f0445d8a6598520824b979.png "[(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate")
[(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate
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CAS No:
115122-06-0
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Formula:
C12H8N2O6S
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Chemical Name:
[(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate
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Synonyms:
ZINC3095586;AKOS001024642;MCULE-2745946874;ST50168560;Z56797010;(4-oxocyclohexa-2,5-dienylidene)azamethyl 3-nitrobenzenesulfonate;(4-oxocyclohexa-2,5-dien-1-ylidene)amino 3-nitrobenzene-1-sulfonate;115122-06-0
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CAS No:
[(4-oxocyclohexa-2,5-dien-1-ylidene)amino] 3-nitrobenzenesulfonate Basic Attributes
308.27 g/mol
308.01030715 g/mol
Computed Properties
Molecular Weight:308.27
XLogP3:1.6
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:308.01030715
Monoisotopic Mass:308.01030715
Topological Polar Surface Area:127
Heavy Atom Count:21
Complexity:605
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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