Water → HCID 59396492, compound

HRID 205784Notes

Reaction equation

HRID 205784 reaction equation
[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[Cl:1][CH2:2][C:3](=[O:4])[Cl:5].[OH2:28].[c:29]1([CH3:30])[cH:31][cH:32][c:33]([S:34]([OH:35])(=[O:36])=[O:37])[cH:38][cH:39]1.[c:6]1([C:12]2([c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[NH:13][CH2:14][CH2:15][c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]32)[cH:7][cH:8][cH:9][cH:10][cH:11]1>>[Cl:1][CH2:2][C:3](=[O:4])[N:13]1[C:12]([c:6]2[cH:7][cH:8][cH:9][cH:10][cH:11]2)([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:21]2[c:16]([cH:17][cH:18][cH:19][cH:20]2)[CH2:15][CH2:14]1

Participants

6

Reactant 5

HCID 962WaterHCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 6577Chloroacetyl chlorideHCID 59396601HCID 59396601, compound

Product 1

HCID 59396492HCID 59396492, compound

Sources & evidence

ORD record
ord-1d4a4e01e0f449cb81a687b97548c040
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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