Acetic Acid → HCID 23363126, compound

HRID 1539769Notes

Reaction equation

HRID 1539769 reaction equation
[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[CH3:32][C:33](=[O:34])[OH:35].[Cl:1][c:2]1[cH:3][c:4]([CH2:20][n:21]2[n:22][cH:23][n:24][cH:25]2)[c:5]([S:8][c:9]2[cH:10][cH:11][c:12]([N+:17]([O-:18])=[O:19])[c:13]([NH:14][CH3:15])[cH:16]2)[cH:6][cH:7]1.[Zn:36]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:20][n:21]2[n:22][cH:23][n:24][cH:25]2)[c:5]([S:8][c:9]2[cH:10][cH:11][c:12]([NH2:17])[c:13]([NH:14][CH3:15])[cH:16]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 8857Ethyl AcetateHCID 23994ZincHCID 15837889HCID 15837889, compound

Product 1

HCID 23363126HCID 23363126, compound

Sources & evidence

ORD record
ord-f300f0d9febd4eae80f54e4dfdc0f77a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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