Acetate → 2-[2-[3-Amino-5-(trifluoromethyl)phenyl]ethenyl]isoindole-1,3-dione

HRID 1114097Notes

Reaction equation

HRID 1114097 reaction equation
[Br:1][c:2]1[cH:3][c:4]([NH2:5])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1.[CH3:13][c:14]1[cH:15][cH:16][cH:17][cH:18][c:19]1[P:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][c:26]1[CH3:27])[c:28]1[cH:29][cH:30][cH:31][cH:32][c:33]1[CH3:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH:42](=[CH2:43])[N:44]1[C:45](=[O:54])[c:46]2[cH:47][cH:48][cH:49][cH:50][c:51]2[C:52]1=[O:53].[O-:56][C:57]([CH3:58])=[O:59].[O-:60][C:61]([CH3:62])=[O:63].[Pd+2:55]>>[c:2]1([CH:43]=[CH:42][N:44]2[C:45](=[O:54])[c:46]3[cH:47][cH:48][cH:49][cH:50][c:51]3[C:52]2=[O:53])[cH:3][c:4]([NH2:5])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1

Participants

7

Reactant 6

HCID 175Acetate2×HCID 8471TriethylamineHCID 770351H-Isoindole-1,3(2H)-dione, 2-ethenyl-HCID 80271Tri-o-tolylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27358803-Bromo-5-(trifluoromethyl)aniline

Product 1

HCID 667215932-[2-[3-Amino-5-(trifluoromethyl)phenyl]ethenyl]isoindole-1,3-dione

Sources & evidence

ORD record
ord-eae5500aa1ab4a84888ecc426bfc2176
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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