Ethanol → HCID 178475453, compound

HRID 1120721Notes

Reaction equation

HRID 1120721 reaction equation
[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH2:10][CH:11]1[O:12][CH:13]([n:23]2[c:24]3[n:25][cH:26][n:27][c:28]([Cl:32])[c:29]3[n:30][cH:31]2)[C:14]([CH3:21])([F:22])[C:15]1([CH3:16])[O:17][C:18]([CH3:19])=[O:20].[CH3:43][CH2:44][OH:45].[F:33][c:34]1[cH:35][cH:36][c:37]([CH2:38][NH2:39])[cH:40][cH:41]1.[OH2:42]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[O:9][CH2:10][CH:11]1[O:12][CH:13]([n:23]2[c:24]3[n:25][cH:26][n:27][c:28]([NH:39][CH2:38][c:37]4[cH:36][cH:35][c:34]([F:33])[cH:41][cH:40]4)[c:29]3[n:30][cH:31]2)[C:14]([CH3:21])([F:22])[C:15]1([CH3:16])[O:17][C:18]([CH3:19])=[O:20]

Participants

5

Reactant 4

HCID 702EthanolHCID 962WaterHCID 673264-FluorobenzylamineHCID 178475442HCID 178475442, compound

Product 1

HCID 178475453HCID 178475453, compound

Sources & evidence

ORD record
ord-f4ca6e5189014b58ad284abce9f61274
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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