Chloride → Sodium ion

HRID 1144535Notes

Reaction equation

HRID 1144535 reaction equation
[Al+3:10].[C:52]([O-:53])(=[O:54])[CH2:55][C:56]([CH2:57][C:58]([O-:59])=[O:60])([C:61]([O-:62])=[O:63])[OH:64].[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1.[Cl-:11].[Cl-:12].[Cl-:9].[Cl:68][CH2:69][Cl:70].[NH2:13][c:14]1[s:15][cH:16][c:17]([C:19]([C:20](=[O:21])[NH:22][CH:23]2[CH:24]3[CH2:25][O:26][C:27]([CH:44]4[O:45][CH2:46][CH2:47][CH2:48]4)=[C:28]([C:32](=[O:33])[O:34][CH2:35][c:36]4[cH:37][cH:38][c:39]([O:40][CH3:41])[cH:42][cH:43]4)[N:29]3[C:30]2=[O:31])=[N:49][O:50][CH3:51])[n:18]1.[Na+:65].[Na+:66].[Na+:67]>>[NH2:13][c:14]1[s:15][cH:16][c:17]([C:19]([C:20](=[O:21])[NH:22][CH:23]2[CH:24]3[CH2:25][O:26][C:27]([CH:44]4[O:45][CH2:46][CH2:47][CH2:48]4)=[C:28]([C:32](=[O:33])[O-:34])[N:29]3[C:30]2=[O:31])=[N:49][O:50][CH3:51])[n:18]1.[Na+:65]

Participants

9

Reactant 7

HCID 312Chloride3×HCID 923Sodium ion3×HCID 6344DichloromethaneHCID 7519AnisoleHCID 31348CitrateHCID 104727Aluminum CationHCID 178502756HCID 178502756, compound

Product 2

HCID 923Sodium ionHCID 178502755HCID 178502755, compound

Sources & evidence

ORD record
ord-b22f6649522d465f8b0a0006d5e4609f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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