Chloride → HCID 136133815, compound

HRID 2327462Notes

Reaction equation

HRID 2327462 reaction equation
[Al+3:2].[C:39](=[O:40])([OH:41])[O-:42].[CH3:31][O:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[CH3:5][O:6][N:7]=[C:8]([c:9]1[c:10]([O:16][CH2:17][c:18]2[cH:19][cH:20][c:21]([Cl:22])[cH:23][cH:24]2)[cH:11][cH:12][c:13]([Cl:15])[cH:14]1)[c:25]1[n:26][o:27][c:28]([CH3:30])[n:29]1.[Cl-:1].[Cl-:3].[Cl-:4].[Na+:43]>>[CH3:5][O:6][N:7]=[C:8]([c:9]1[c:10]([OH:16])[cH:11][cH:12][c:13]([Cl:15])[cH:14]1)[c:25]1[n:26][o:27][c:28]([CH3:30])[n:29]1

Participants

7

Reactant 6

HCID 312Chloride3×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 7519AnisoleHCID 104727Aluminum CationHCID 53672687HCID 53672687, compound

Product 1

HCID 136133815HCID 136133815, compound

Sources & evidence

ORD record
ord-e0ba7f7671e34b69b0bdf546a1947a48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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