Ammonium → HCID 66916353, compound

HRID 112309Notes

Reaction equation

HRID 112309 reaction equation
[CH3:64][OH:65].[Cl-:56].[Cl:29][c:30]1[c:31]([O:32][c:33]2[cH:34][cH:35][n:36][c:37]3[cH:38][c:39]([O:47][CH3:48])[c:40]([C:43](=[O:44])[O:45][CH3:46])[cH:41][c:42]23)[cH:49][cH:50][c:51]([N+:53]([O-:54])=[O:55])[cH:52]1.[Fe:58].[NH2:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[c:8]3[c:9]([cH:10][c:11]([O:12][CH3:13])[c:14]([C:15]([O:16][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:21])[cH:22]3)[n:23][cH:24][cH:25]2)[c:26]([F:27])[cH:28]1.[NH4+:57].[O:59]1[CH2:60][CH2:61][CH2:62][CH2:63]1.[OH2:66]>>[Cl:29][c:30]1[c:31]([O:32][c:33]2[cH:34][cH:35][n:36][c:37]3[cH:38][c:39]([O:47][CH3:48])[c:40]([C:43](=[O:44])[O:45][CH3:46])[cH:41][c:42]23)[cH:49][cH:50][c:51]([NH2:53])[cH:52]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 887MethanolHCID 962WaterHCID 8028TetrahydrofuranHCID 23925IronHCID 66916250HCID 66916250, compoundHCID 86650697HCID 86650697, compound

Product 1

HCID 66916353HCID 66916353, compound

Sources & evidence

ORD record
ord-facaca16c19243dcbcb6e6a5d9825008
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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