1-Chloro-4-iodobenzene → {4-[3-(4-Chloro-phenyl)-prop-2-ynylsulfanyl]-2-methyl-phenoxy}-acetic acid tert-butyl ester

HRID 1564750Notes

Reaction equation

HRID 1564750 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[c:10]([CH3:19])[cH:11][c:12]([S:15][CH2:16][C:17]#[CH:18])[cH:13][cH:14]1)=[O:20].[Cl:21][c:22]1[cH:23][cH:24][c:25]([I:28])[cH:26][cH:27]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[c:10]([CH3:19])[cH:11][c:12]([S:15][CH2:16][C:17]#[C:18][c:25]2[cH:24][cH:23][c:22]([Cl:21])[cH:27][cH:26]2)[cH:13][cH:14]1)=[O:20]

Participants

3

Reactant 2

HCID 125101-Chloro-4-iodobenzeneHCID 86602538(2-Methyl-4-prop-2-ynylsulfanyl-phenoxy)-acetic acid tert-butyl ester

Product 1

HCID 69461193{4-[3-(4-Chloro-phenyl)-prop-2-ynylsulfanyl]-2-methyl-phenoxy}-acetic acid tert-butyl ester

Sources & evidence

ORD record
ord-da9939630edb4ef98edf93a903923599
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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