Ethanol → HCID 19068788, compound

HRID 187619Notes

Reaction equation

HRID 187619 reaction equation
[CH3:55][CH2:56][O-:57].[CH3:58][CH2:59][OH:60].[Cl:1][c:2]1[c:3](-[c:4]2[cH:5][cH:6][c:7]([Cl:8])[c:9]([NH:10][S:11]([CH3:12])(=[O:13])=[O:14])[cH:15]2)[n:16][cH:17][c:18]([C:19]([F:20])([F:21])[F:22])[cH:23]1.[Cl:24][c:25]1[c:26](-[c:35]2[cH:36][c:37]([N:43]([S:44](=[O:45])(=[O:46])[CH2:47][CH3:48])[S:49]([CH2:50][CH3:51])(=[O:52])=[O:53])[c:38]([C:41]#[N:42])[cH:39][cH:40]2)[n:27][cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1.[Na+:54]>>[Cl:24][c:25]1[c:26](-[c:35]2[cH:36][c:37]([NH:43][S:44](=[O:45])(=[O:46])[CH2:47][CH3:48])[c:38]([C:41]#[N:42])[cH:39][cH:40]2)[n:27][cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 1194401-Hydroxyethyl radicalHCID 15766881HCID 15766881, compoundHCID 19068774HCID 19068774, compound

Product 1

HCID 19068788HCID 19068788, compound

Sources & evidence

ORD record
ord-88378b9645074ae39885582d0d264db7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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