Ethanol → HCID 178458223, compound

HRID 700733Notes

Reaction equation

HRID 700733 reaction equation
[CH2:45]([O:46][CH2:47][CH3:48])[CH3:49].[CH3:50][CH2:51][OH:52].[F:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]2[NH:7][C:8](=[O:38])[O:9][CH:10]2[CH:11]2[N:12]([CH:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:13][c:14]3[c:15]([O:21][CH2:22][CH:23]=[CH2:24])[cH:16][cH:17][cH:18][c:19]3[CH2:20]2)[cH:39][c:40]([F:42])[cH:41]1.[Li+:44].[OH-:43].[OH2:53]>>[F:1][c:2]1[cH:3][c:4]([CH2:5][CH:6]([NH2:7])[CH:10]([OH:9])[CH:11]2[N:12]([CH:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:32]3[cH:33][cH:34][cH:35][cH:36][cH:37]3)[CH2:13][c:14]3[c:15]([O:21][CH2:22][CH:23]=[CH2:24])[cH:16][cH:17][cH:18][c:19]3[CH2:20]2)[cH:39][c:40]([F:42])[cH:41]1

Participants

7

Reactant 6

HCID 702EthanolHCID 961HydroxideHCID 962WaterHCID 3283Diethyl EtherHCID 28486Lithium ionHCID 178458222HCID 178458222, compound

Product 1

HCID 178458223HCID 178458223, compound

Sources & evidence

ORD record
ord-5ac55dea1bd84e2c95d85fdfd658c710
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…