Acetic Acid → 1-Ethyl-5-methyl-5-(4,5,6,7-tetrafluoro-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione

HRID 100258

반응식

HRID 100258 반응식
[C:29]([OH:30])(=[O:31])[CH3:32].[F:14][c:15]1[c:16]([F:28])[c:17]([F:27])[c:18]([F:26])[c:19]2[c:20]1[C:21](=[O:22])[O:23][C:24]2=[O:25].[NH2:1][C:2]1([CH3:13])[C:3](=[O:12])[NH:4][C:5](=[O:11])[N:6]([CH2:9][CH3:10])[C:7]1=[O:8]>>[N:1]1([C:2]2([CH3:13])[C:3](=[O:12])[NH:4][C:5](=[O:11])[N:6]([CH2:9][CH3:10])[C:7]2=[O:8])[C:21](=[O:22])[c:20]2[c:15]([F:14])[c:16]([F:28])[c:17]([F:27])[c:18]([F:26])[c:19]2[C:24]1=[O:23]

참가 물질

4

반응물 3

HCID 176Acetic AcidHCID 69545Tetrafluorophthalic anhydrideHCID 668110525-Amino-1-ethyl-5-methylbarbituric acid

생성물 1

HCID 247656681-Ethyl-5-methyl-5-(4,5,6,7-tetrafluoro-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione

출처 및 근거

ORD 기록
ord-2dfb1bf4a63c409da329a7b48e4da1fa
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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