Toluene → HCID 178498751, compound

HRID 1129228Notes

Reaction equation

HRID 1129228 reaction equation
[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[Cl:32][C:33]([Cl:34])=[O:35].[Cl:36][CH2:37][Cl:38].[O:1]=[S:2]1(=[O:24])[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:23])[cH:10][c:11]([NH:15][CH2:16][CH:17]([C:18](=[O:19])[O:20][CH3:21])[OH:22])[cH:12][c:13]2[F:14])[CH2:6][CH2:7]1>>[O:1]=[S:2]1(=[O:24])[CH2:3][CH2:4][N:5]([c:8]2[c:9]([F:23])[cH:10][c:11]([N:15]3[CH2:16][CH:17]([C:18](=[O:19])[O:20][CH3:21])[O:22][C:33]3=[O:35])[cH:12][c:13]2[F:14])[CH2:6][CH2:7]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 6344DichloromethaneHCID 6371PhosgeneHCID 8471TriethylamineHCID 178501843HCID 178501843, compound

Product 1

HCID 178498751HCID 178498751, compound

Sources & evidence

ORD record
ord-e7d56783e17c4be98efaf01a8625ef69
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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