4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid
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![4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/94b6352e7fd3477381b84fe8acb091bf.png "4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid")
4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid
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CAS No:
340317-72-8
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Formula:
C14H12N2O5
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Chemical Name:
4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid
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Synonyms:
4-(1,3-Dimethyl-2,4,6-trioxo-tetrahydro-pyrimidin-5-ylidenemethyl)-benzoic acid;CHEMBL404693;340317-72-8;4-[(1,3-dimethyl-2,4,6-trioxo-1,3-dihydropyrimidin-5-ylidene)methyl]benzoic ac id;CBMicro_038820;4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid;ZINC2889629;BDBM50375178;SBB027606;STK170878;AKOS000301049;MCULE-9396046770;BIM-0038826.P001;ST50265813;AN-655/12947027;4-[(1,3-dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]benzoicacid;4-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]benzoic acid;4-(1,3-dimethyl-2,4,6-trioxo-tetrahydro-pyrimidin-5-ylidenemethyl)-benzoic acid, AldrichCPR
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CAS No:
4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]benzoic acid Basic Attributes
288.25 g/mol
288.07462149 g/mol
Computed Properties
Molecular Weight:288.25
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:288.07462149
Monoisotopic Mass:288.07462149
Topological Polar Surface Area:95
Heavy Atom Count:21
Complexity:506
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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