Acetic Acid → HCID 58913074, compound

HRID 688700Notes

Reaction equation

HRID 688700 reaction equation
[Br:38][Br:39].[C:41]([OH:42])(=[O:43])[CH3:44].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([CH2:24][c:25]3[cH:26][cH:27][c:28]([O:31][C:32]([C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[cH:29][cH:30]3)[c:8](-[c:14]3[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]3)[c:9](=[O:13])[o:10][c:11]2[cH:12]1.[OH2:40]>>[CH3:1][O:2][c:3]1[c:4]([Br:38])[cH:5][c:6]2[c:7]([CH2:24][c:25]3[cH:26][cH:27][c:28]([O:31][C:32]([C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[cH:29][cH:30]3)[c:8](-[c:14]3[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]3)[c:9](=[O:13])[o:10][c:11]2[cH:12]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 24408BromineHCID 58913114HCID 58913114, compound

Product 1

HCID 58913074HCID 58913074, compound

Sources & evidence

ORD record
ord-357b5df521b645649f943178eeb43072
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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