Chloride → HCID 72316532, compound

HRID 698928Notes

Reaction equation

HRID 698928 reaction equation
[Cl-:43].[Cl:1][C:2]([Cl:3])([O:4][C:5]([O:6][C:7]([Cl:9])([Cl:10])[Cl:11])=[O:8])[Cl:12].[Cl:45][CH2:46][Cl:47].[F:19][c:20]1[cH:21][cH:22][c:23]([CH:26]([CH3:27])[NH:28][C:29](=[O:30])[C:31]2([c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]2)[cH:24][cH:25]1.[Na+:44].[OH2:48].[cH:13]1[cH:14][cH:15][n:16][cH:17][cH:18]1>>[O:6]=[C:7]([Cl:10])[N:34]1[CH2:33][CH2:32][C:31]([C:29]([NH:28][CH:26]([c:23]2[cH:22][cH:21][c:20]([F:19])[cH:25][cH:24]2)[CH3:27])=[O:30])([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[CH2:36][CH2:35]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 923Sodium ionHCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 94429TriphosgeneHCID 178464681HCID 178464681, compound

Product 1

HCID 72316532HCID 72316532, compound

Sources & evidence

ORD record
ord-a97e7cb41c554f8a96c41a9c874f6201
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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