Carbon Dioxide → 4-Bromo-2,3,5,6-tetrafluorobenzoic acid

HRID 1212348Notes

Reaction equation

HRID 1212348 reaction equation
[Br:29][c:30]1[c:31]([F:40])[c:32]([F:39])[c:33]([Br:38])[c:34]([F:37])[c:35]1[F:36].[CH3:1][c:2]1[cH:3][c:4](-[c:5]2[c:6]([F:7])[c:8]([F:9])[c:10]3[c:11](=[O:12])[c:13]([C:23](=[O:24])[OH:25])[cH:14][n:15]4[c:21]3[c:20]2[O:19][CH2:18][CH:16]4[CH3:17])[cH:22][c:26]([CH3:27])[n:28]1.[Li:41][CH2:42][CH2:43][CH2:44][CH3:45].[O:46]=[C:47]=[O:48]>>[C:23](=[O:24])([OH:25])[c:30]1[c:31]([F:40])[c:32]([F:39])[c:33]([Br:38])[c:34]([F:37])[c:35]1[F:36]

Participants

5

Reactant 4

HCID 280Carbon DioxideHCID 676531,4-Dibromo-2,3,5,6-tetrafluorobenzeneHCID 1450136010-(2,6-dimethyl-4-pyridinyl)-8,9-difluoro-3-methyl-7-oxo-2,3-dihydro-7H-pyrido[1,2,3-de][1,4]benzoxazine6-carboxylic acidHCID 178418339Butyllithium

Product 1

HCID 2981734-Bromo-2,3,5,6-tetrafluorobenzoic acid

Sources & evidence

ORD record
ord-1558b5f6eda14b3bbe0aee6a540ac546
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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