Water → HCID 58346586, compound

HRID 1228260Notes

Reaction equation

HRID 1228260 reaction equation
[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[Cl:1][c:2]1[cH:3][c:4]([NH:17][c:18]2[n:19][cH:20][n:21][c:22]3[c:23]2[c:24]2[c:25]([s:39]3)-[c:26]3[cH:27][n:28]([CH:33]4[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]4)[n:29][c:30]3[CH2:31][CH2:32]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][c:10]1[cH:11][c:12]([F:16])[cH:13][cH:14][cH:15]1.[Cl:40][CH2:41][C:42](=[O:43])[Cl:44].[Cl:52][CH2:53][Cl:54].[OH2:55]>>[Cl:1][c:2]1[cH:3][c:4]([NH:17][c:18]2[n:19][cH:20][n:21][c:22]3[c:23]2[c:24]2[c:25]([s:39]3)-[c:26]3[cH:27][n:28]([CH:33]4[CH2:34][CH2:35][N:36]([C:42]([CH2:41][Cl:40])=[O:43])[CH2:37][CH2:38]4)[n:29][c:30]3[CH2:31][CH2:32]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][c:10]1[cH:11][c:12]([F:16])[cH:13][cH:14][cH:15]1

Participants

6

Reactant 5

HCID 962WaterHCID 6344DichloromethaneHCID 6577Chloroacetyl chlorideHCID 8471TriethylamineHCID 58346593HCID 58346593, compound

Product 1

HCID 58346586HCID 58346586, compound

Sources & evidence

ORD record
ord-053940a8334f4587b053386d147376e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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