Ethanol → HCID 68153913, compound

HRID 2135938Notes

Reaction equation

HRID 2135938 reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([F:19])[c:6]([F:18])[c:7](-[c:10]2[cH:11][cH:12][c:13]([CH:16]=[O:17])[cH:14][cH:15]2)[cH:8][cH:9]1.[CH2:20]([O:21][P:22]([O:23][CH2:24][CH3:25])(=[O:26])[CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH3:27].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:42][CH2:43][O-:44].[CH3:45][CH2:46][OH:47].[Na+:41].[OH2:48]>>[CH2:1]([CH3:2])[O:3][c:4]1[c:5]([F:19])[c:6]([F:18])[c:7](-[c:10]2[cH:11][cH:12][c:13]([CH2:16][CH2:28][C:29](=[O:30])[O:31][CH2:32][CH3:33])[cH:14][cH:15]2)[cH:8][cH:9]1

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 13345Triethyl phosphonoacetateHCID 1194401-Hydroxyethyl radicalHCID 86668462HCID 86668462, compound

Product 1

HCID 68153913HCID 68153913, compound

Sources & evidence

ORD record
ord-1d3cd4dd6b4a4e41a11d4fc4d5a2c72e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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