Sodium ion → HCID 67385193, compound

HRID 86597Notes

Reaction equation

HRID 86597 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH3:8][N:9]([CH3:10])[CH2:11][CH2:12][OH:13].[Cl:14][c:15]1[cH:16][cH:17][c:18]([N:21]2[CH2:22][CH2:23][c:24]3[c:25]2[n:26][c:27]([N:55]2[CH2:56][CH2:57][O:58][CH2:59][CH2:60]2)[n:28][c:29]3-[c:30]2[cH:31][n:32][c:33]([N:36]([CH2:37][c:38]3[cH:39][cH:40][c:41]([O:44][CH3:45])[cH:42][cH:43]3)[CH2:46][c:47]3[cH:48][cH:49][c:50]([O:53][CH3:54])[cH:51][cH:52]3)[n:34][cH:35]2)[cH:19][n:20]1.[H-:62].[Na+:61].[OH2:63]>>[CH3:8][N:9]([CH3:10])[CH2:11][CH2:12][O:13][c:15]1[cH:16][cH:17][c:18]([N:21]2[CH2:22][CH2:23][c:24]3[c:25]2[n:26][c:27]([N:55]2[CH2:56][CH2:57][O:58][CH2:59][CH2:60]2)[n:28][c:29]3-[c:30]2[cH:31][n:32][c:33]([N:36]([CH2:37][c:38]3[cH:39][cH:40][c:41]([O:44][CH3:45])[cH:42][cH:43]3)[CH2:46][c:47]3[cH:48][cH:49][c:50]([O:53][CH3:54])[cH:51][cH:52]3)[n:34][cH:35]2)[cH:19][n:20]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 79022-(Dimethylamino)ethanolHCID 166653HydrideHCID 59244926HCID 59244926, compound

Product 1

HCID 67385193HCID 67385193, compound

Sources & evidence

ORD record
ord-bf3820527d3f47539e8935bbc8c92519
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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