Chloride → HCID 59594390, compound

HRID 675731Notes

Reaction equation

HRID 675731 reaction equation
[Al+3:40].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:49][O:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl-:39].[Cl-:41].[Cl-:42].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:37][cH:38]1)[N:6]([CH2:28][c:29]1[cH:30][cH:31][c:32]([O:33][CH3:34])[cH:35][cH:36]1)[C:7](=[O:27])[CH:8]([CH2:19][c:20]1[c:21]([Cl:26])[cH:22][cH:23][cH:24][cH:25]1)[N:9]=[C:10]2[c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:37][cH:38]1)[NH:6][C:7](=[O:27])[CH:8]([CH2:19][c:20]1[c:21]([Cl:26])[cH:22][cH:23][cH:24][cH:25]1)[N:9]=[C:10]2[c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1

Participants

6

Reactant 5

HCID 312Chloride3×HCID 7519AnisoleHCID 8857Ethyl AcetateHCID 104727Aluminum CationHCID 59594394HCID 59594394, compound

Product 1

HCID 59594390HCID 59594390, compound

Sources & evidence

ORD record
ord-66217f3a51884b0fbd19cad0a196139a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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