Toluene → HCID 68541954, compound

HRID 197521Notes

Reaction equation

HRID 197521 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([NH:15][CH2:16][CH2:17][NH:18][CH:19]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])[cH:13][cH:14]1.[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[Cl:37][C:38]([Cl:39])=[O:40]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([N:15]2[CH2:16][CH2:17][N:18]([CH:19]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])[C:38]2=[O:40])[cH:13][cH:14]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6371PhosgeneHCID 81531DiisopropylethylamineHCID 68539455HCID 68539455, compound

Product 1

HCID 68541954HCID 68541954, compound

Sources & evidence

ORD record
ord-e008f6f21ad643bf981048bd38385845
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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