Chloride → HCID 22048482, compound

HRID 1237680Notes

Reaction equation

HRID 1237680 reaction equation
[CH2:36]([N+:37]([CH2:38][CH3:39])([CH2:40][CH3:41])[CH2:42][CH3:43])[c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:29][CH2:30][O:31][C:32]([CH3:33])=[O:34].[Cl-:35].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][c:10](=[O:26])[nH:11][c:12]3[cH:13][cH:14][c:15]([CH:18]([c:19]4[cH:20][n:21][cH:22][n:23]4[CH3:24])[OH:25])[cH:16][c:17]23)[cH:5][cH:6][cH:7]1.[I:27][CH3:28].[Na+:56].[OH-:55]>>[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][c:10](=[O:26])[n:11]([CH3:29])[c:12]3[cH:13][cH:14][c:15]([CH:18]([c:19]4[cH:20][n:21][cH:22][n:23]4[CH3:24])[OH:25])[cH:16][c:17]23)[cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 6328Methyl iodideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 17208BenzyltriethylammoniumHCID 22048484HCID 22048484, compound

Product 1

HCID 22048482HCID 22048482, compound

Sources & evidence

ORD record
ord-70d765da979d438cb8326b8e29ff2068
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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