Acetic Acid → HCID 11466590, compound

HRID 669245Notes

Reaction equation

HRID 669245 reaction equation
[BrH:40].[C:43]([OH:44])(=[O:45])[CH3:46].[CH3:1][O:2][c:3]1[c:4]([CH3:39])[cH:5][c:6]2[c:7]([CH2:24][c:25]3[cH:26][cH:27][c:28]([O:31][CH2:32][CH2:33][N:34]4[CH2:35][CH2:36][CH2:37][CH2:38]4)[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.[Na+:42].[OH-:41]>>[OH:2][c:3]1[c:4]([CH3:39])[cH:5][c:6]2[c:7]([CH2:24][c:25]3[cH:26][cH:27][c:28]([O:31][CH2:32][CH2:33][N:34]4[CH2:35][CH2:36][CH2:37][CH2:38]4)[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

6

Reactant 5

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 923Sodium ionHCID 961HydroxideHCID 58913086HCID 58913086, compound

Product 1

HCID 11466590HCID 11466590, compound

Sources & evidence

ORD record
ord-d5ef1f289c3a436faa4e1d4f87810ede
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…