2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid
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![2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d69dccbc1dcc41968377bc768266fb17.png "2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid")
2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid
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CAS No:
330951-90-1
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Formula:
C13H8Br2N2O6
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Chemical Name:
2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid
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Synonyms:
{2,6-dibromo-4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}acetic acid;ZINC2228740;STK177177;STK606752;AKOS000322370;AKOS005542450;MCULE-6264994157;ST51010948;SR-01000080745;SR-01000080745-1;Z56808831;2-{2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}acetic acid;{2,6-dibromo-4-[(Z)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-ylidene)methyl]phenoxy}acetic acid;2-{2,6-dibromo-4-[(2,4,6-trioxo(1,3-dihydropyrimidin-5-ylidene))methyl]phenoxy }acetic acid;330951-90-1
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CAS No:
2-[2,6-dibromo-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid Basic Attributes
448.02 g/mol
447.87286 g/mol
Computed Properties
Molecular Weight:448.02
XLogP3:1.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:447.87286
Monoisotopic Mass:445.87491
Topological Polar Surface Area:122
Heavy Atom Count:23
Complexity:545
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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