Acetic Acid → Methyl 6-bromomethyl-4-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylate

HRID 1556929Notes

Reaction equation

HRID 1556929 reaction equation
[BrH:31].[C:27]([OH:28])(=[O:29])[CH3:30].[CH3:1][c:2]1[c:3]([C:23](=[O:24])[O:25][CH3:26])[c:4](-[c:14]2[cH:15][c:16]([N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]2)[n:5][c:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[n:7]1.[CH3:33][C:34](=[O:35])[OH:36].[OH2:32]>>[CH2:1]([c:2]1[c:3]([C:23](=[O:24])[O:25][CH3:26])[c:4](-[c:14]2[cH:15][c:16]([N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]2)[n:5][c:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[n:7]1)[Br:31]

Participants

5

Reactant 4

HCID 176Acetic Acid2×HCID 260Hydrogen BromideHCID 962WaterHCID 15147475Methyl 6-methyl-2-phenyl-4-(3-nitrophenyl)-5-pyrimidinecarboxylate

Product 1

HCID 10410300Methyl 6-bromomethyl-4-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylate

Sources & evidence

ORD record
ord-024df2ff4fff4be197900505cbea0a45
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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