Benzene → HCID 20402697, compound

HRID 163277Notes

Reaction equation

HRID 163277 reaction equation
[C:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)(=[O:30])[Cl:31].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:46][CH2:47][OH:48].[Cl:1][c:2]1[c:3]([C:8]2=[N:14][CH:13]([OH:15])[C:12](=[O:16])[N:11]([CH3:17])[c:10]3[c:9]2[c:20]([CH3:21])[n:19]([CH3:22])[cH:18]3)[cH:4][cH:5][cH:6][cH:7]1.[OH2:39].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[Cl:1][c:2]1[c:3]([C:8]2=[N:14][CH:13]([O:15][C:23]([c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:30])[C:12](=[O:16])[N:11]([CH3:17])[c:10]3[c:9]2[c:20]([CH3:21])[n:19]([CH3:22])[cH:18]3)[cH:4][cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 241BenzeneHCID 702EthanolHCID 962WaterHCID 7412Benzoyl chlorideHCID 8471TriethylamineHCID 20402684HCID 20402684, compound

Product 1

HCID 20402697HCID 20402697, compound

Sources & evidence

ORD record
ord-00be4188d77c407194bc3d0b0ac48223
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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