Ethanol → HCID 178519198, compound

HRID 151228Notes

Reaction equation

HRID 151228 reaction equation
[C:40]([O:41][CH2:42][CH3:43])(=[O:44])[CH3:45].[CH2:46]([OH:47])[CH3:48].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][cH:9][c:10]([N:13]3[C:14](=[O:35])[O:15][CH:16]([CH2:26][O:27][CH2:28][c:29]4[cH:30][cH:31][cH:32][cH:33][cH:34]4)[CH:17]3[c:18]3[cH:19][c:20]([F:25])[cH:21][c:22]([F:24])[cH:23]3)[cH:11][cH:12]2)[cH:36][cH:37]1.[H:38][H:39]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][c:7]2[cH:8][cH:9][c:10]([N:13]3[C:14](=[O:35])[O:15][CH:16]([CH2:26][OH:27])[CH:17]3[c:18]3[cH:19][c:20]([F:25])[cH:21][c:22]([F:24])[cH:23]3)[cH:11][cH:12]2)[cH:36][cH:37]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8857Ethyl AcetateHCID 178418361HCID 178418361, compoundHCID 178519191HCID 178519191, compound

Product 1

HCID 178519198HCID 178519198, compound

Sources & evidence

ORD record
ord-639cfdf80c274d0481f7a32f23a17283
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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