Chloride → 2-[2-(4'-Chloro-biphenyl-4-YL)-2-oxo-ethyl]acrylic acid

HRID 290209

Reaction equation

HRID 290209 reaction equation
[Al+3:2].[C:5]1(=[O:12])[C:6](=[CH2:7])[CH2:8][C:9](=[O:10])[O:11]1.[Cl-:1].[Cl-:3].[Cl-:4].[Cl:13][c:14]1[cH:15][cH:16][c:17](-[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:18][cH:19]1.[Cl:27][c:28]1[cH:29][cH:30][cH:31][cH:32][c:33]1[Cl:34].[ClH:26].[OH2:35]>>[C:5]([C:6](=[CH2:7])[CH2:8][C:9](=[O:10])[c:23]1[cH:22][cH:21][c:20](-[c:17]2[cH:16][cH:15][c:14]([Cl:13])[cH:19][cH:18]2)[cH:25][cH:24]1)([OH:11])=[O:12]

Participants

8

Reactant 7

HCID 312Chloride3×HCID 313Hydrochloric AcidHCID 962WaterHCID 72391,2-DichlorobenzeneHCID 163234-ChlorobiphenylHCID 75110Itaconic AnhydrideHCID 104727Aluminum Cation

Product 1

HCID 98393182-[2-(4'-Chloro-biphenyl-4-YL)-2-oxo-ethyl]acrylic acid

Sources & evidence

ORD record
ord-4ee38ac14e0d41688389d7dc65fc2177
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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