Ethanol → HCID 178475451, compound

HRID 1545879Notes

Reaction equation

HRID 1545879 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].[CH3:42][CH2:43][OH:44].[NH2:33][CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[OH2:41]>>[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:33][CH2:34][c:35]4[cH:36][cH:37][cH:38][cH:39][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 7504BenzylamineHCID 178475442HCID 178475442, compound

Product 1

HCID 178475451HCID 178475451, compound

Sources & evidence

ORD record
ord-478267941dcc4d3bb2cabd36e575fb61
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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