Benzene → HCID 20256285, compound

HRID 2331465Notes

Reaction equation

HRID 2331465 reaction equation
[CH2:42]([Cl:43])[Cl:44].[CH3:26][N:27]([CH3:28])[c:29]1[c:30]2[c:31]([cH:32][cH:33][cH:34][c:35]2[N:36]([CH3:37])[CH3:38])[cH:39][cH:40][cH:41]1.[CH3:45][CH2:46][CH2:47][CH2:48][CH2:49][CH3:50].[Cl:16][C:17]([Cl:18])=[O:19].[Cl:1][c:2]1[cH:3][c:4]([O:5][CH2:6][CH2:7][NH:8][CH:9]([CH3:10])[CH3:11])[cH:12][c:13]([Cl:15])[cH:14]1.[cH:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[Cl:1][c:2]1[cH:3][c:4]([O:5][CH2:6][CH2:7][N:8]([CH:9]([CH3:10])[CH3:11])[C:17]([Cl:16])=[O:19])[cH:12][c:13]([Cl:15])[cH:14]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 6344DichloromethaneHCID 6371PhosgeneHCID 8058HexaneHCID 88675Proton spongeHCID 20256258HCID 20256258, compound

Product 1

HCID 20256285HCID 20256285, compound

Sources & evidence

ORD record
ord-89a69bd18fe64957b054b9653b790c49
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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