Ammonium → HCID 67040841, compound

HRID 693781Notes

Reaction equation

HRID 693781 reaction equation
[CH3:49][CH2:50][OH:51].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[Cl-:47].[Fe:64].[NH4+:48].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:57].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16]([NH:17][c:18]1[cH:19][cH:20][c:21]([S:24][c:25]3[c:26]([N+:43]([O-:44])=[O:45])[cH:27][c:28]([C:31]([NH:32][c:33]4[s:34][c:35]([C:38]([F:39])([F:40])[F:41])[n:36][n:37]4)=[O:42])[cH:29][cH:30]3)[cH:22][cH:23]1)=[O:46])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:13]1[CH:12]([CH2:14][O:15][C:16]([NH:17][c:18]1[cH:19][cH:20][c:21]([S:24][c:25]3[c:26]([NH2:43])[cH:27][c:28]([C:31]([NH:32][c:33]4[s:34][c:35]([C:38]([F:39])([F:40])[F:41])[n:36][n:37]4)=[O:42])[cH:29][cH:30]3)[cH:22][cH:23]1)=[O:46])[c:11]1[c:6]-2[cH:7][cH:8][cH:9][cH:10]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 702EthanolHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 23925IronHCID 67040654HCID 67040654, compound

Product 1

HCID 67040841HCID 67040841, compound

Sources & evidence

ORD record
ord-499944b2a59a48faae2bf7c006281f0e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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