Acetic Acid → HCID 22171451, compound

HRID 1205269Notes

Reaction equation

HRID 1205269 reaction equation
[Br-:27].[CH3:22][C:23](=[O:24])[OH:25].[CH3:28][N+:29]([CH3:30])([CH3:31])[CH3:32].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Cl:1][c:2]1[cH:3][c:4]([CH:9]([CH2:10][NH:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([OH:20])[cH:18][cH:19]2)[OH:21])[cH:5][n:6][c:7]1[Cl:8].[OH2:26].[Zn:39]>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]([CH2:10][NH:11][CH2:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([OH:20])[cH:18][cH:19]2)[OH:21])[cH:5][n:6][cH:7]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 259Bromide ionHCID 962WaterHCID 6380TetramethylammoniumHCID 8857Ethyl AcetateHCID 23994ZincHCID 178516030HCID 178516030, compound

Product 1

HCID 22171451HCID 22171451, compound

Sources & evidence

ORD record
ord-3d4093ee641f479781f91449421f20e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…