Chloride → 2-Benzoylbenzoic Acid

HRID 1218272Notes

Reaction equation

HRID 1218272 reaction equation
[Al+3:13].[Cl-:12].[Cl-:14].[Cl-:15].[Cl-:16].[Cl-:37].[Cl-:39].[Cl:21][CH2:22][C:23]([Cl:24])([Cl:25])[Cl:26].[Cl:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[ClH:36].[F:17][B:18]([F:19])[F:20].[O-:27][N+:28](=[O:29])[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[O:1]=[C:2]1[O:3][C:4](=[O:5])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]21.[S:47]=[C:48]=[S:49].[Zn+2:38]>>[O:1]=[C:2]([OH:3])[c:11]1[c:6]([C:4](=[O:5])[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:7][cH:8][cH:9][cH:10]1

Participants

11

Reactant 10

HCID 312Chloride6×HCID 313Hydrochloric AcidHCID 6348Carbon DisulfideHCID 6356Boron trifluorideHCID 6811Phthalic AnhydrideHCID 7416NitrobenzeneHCID 7964ChlorobenzeneHCID 124181,1,1,2-TetrachloroethaneHCID 32051Zinc(2+)HCID 104727Aluminum Cation

Product 1

HCID 68132-Benzoylbenzoic Acid

Sources & evidence

ORD record
ord-4220b6dcac214b6aa9c82a4efcd5e4c1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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