Ethanol → HCID 178472226, compound

HRID 145126Notes

Reaction equation

HRID 145126 reaction equation
[CH3:31][CH2:32][OH:33].[Cl:1][c:2]1[c:3]([F:19])[cH:4][c:5]2[c:6]([OH:18])[c:7]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[c:8]([SH:12])[n:9][c:10]2[cH:11]1.[Cl:21][CH2:22][C:23]([CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])=[O:30].[Na:20]>>[Cl:1][c:2]1[c:3]([F:19])[cH:4][c:5]2[c:6]([OH:18])[c:7]([C:13](=[O:14])[O:15][CH2:16][CH3:17])[c:8]([S:12][CH2:22][C:23]([CH2:24][C:25](=[O:26])[O:27][CH2:28][CH3:29])=[O:30])[n:9][c:10]2[cH:11]1

Participants

5

Reactant 4

HCID 702EthanolHCID 69484Ethyl 4-chloroacetoacetateHCID 5360545SodiumHCID 178470129HCID 178470129, compound

Product 1

HCID 178472226HCID 178472226, compound

Sources & evidence

ORD record
ord-0808e2b7d0b146758530ded26631478f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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