Ammonium → HCID 22031644, compound

HRID 2146881Notes

Reaction equation

HRID 2146881 reaction equation
[CH3:46][OH:47].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Cl-:48].[NH4+:49].[Na+:45].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[OH-:44].[OH2:50].[n:1]1[c:2](-[c:7]2[cH:8][n:9][c:10]3[n:11]2[cH:12][c:13](-[c:16]2[c:17]([C:40](=[O:41])[O:42][CH3:43])[n:18][n:19]([C:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:20]2)[cH:14][cH:15]3)[cH:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2](-[c:7]2[cH:8][n:9][c:10]3[n:11]2[cH:12][c:13](-[c:16]2[c:17]([C:40](=[O:41])[OH:42])[n:18][n:19]([C:21]([c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:20]2)[cH:14][cH:15]3)[cH:3][cH:4][cH:5][cH:6]1

Participants

10

Reactant 9

HCID 223AmmoniumHCID 312ChlorideHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 22031150HCID 22031150, compound

Product 1

HCID 22031644HCID 22031644, compound

Sources & evidence

ORD record
ord-362e5d06ee854e878af9d4edba671b5e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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