Bromide ion → HCID 13535661, compound

HRID 2153312Notes

Reaction equation

HRID 2153312 reaction equation
[Br-:29].[CH2:30]([N+:31]([CH2:32][CH3:33])([CH2:34][CH3:35])[CH2:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)[CH3:43].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Cl:13][c:14]1[cH:15][cH:16][c:17]([O:18][C:19]([CH2:20][OH:21])([CH3:22])[CH3:23])[cH:24][cH:25]1.[F:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([CH2:9][Cl:10])[cH:11][cH:12]1.[Na+:27].[OH-:26].[OH2:28]>>[F:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([CH2:9][O:21][CH2:20][C:19]([O:18][c:17]2[cH:16][cH:15][c:14]([Cl:13])[cH:25][cH:24]2)([CH3:22])[CH3:23])[cH:11][cH:12]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 17208BenzyltriethylammoniumHCID 191086602-(4-Chlorophenoxy)-2-methylpropan-1-olHCID 202592671-(Chloromethyl)-4-(2-fluoroethoxy)benzene

Product 1

HCID 13535661HCID 13535661, compound

Sources & evidence

ORD record
ord-5068645492bd4f15ab3218e23fb80771
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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