Acetic Acid → HCID 136168658, compound

HRID 1555739Notes

Reaction equation

HRID 1555739 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:41][CH3:42])[cH:11][c:12]2[c:13]([O:19][c:20]3[c:21]([F:40])[cH:22][c:23]([NH:26][C:27]([C:28](=[O:29])[NH:30][CH2:31][CH2:32][c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)=[O:39])[cH:24][cH:25]3)[cH:14][cH:15][n:16][c:17]2[cH:18]1.[CH3:43][OH:44].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[CH3:59][C:60](=[O:61])[OH:62].[Cl:50][CH2:51][Cl:52].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[OH-:63].[OH-:65].[Pd+2:64]>>[OH:8][c:9]1[c:10]([O:41][CH3:42])[cH:11][c:12]2[c:13]([O:19][c:20]3[c:21]([F:40])[cH:22][c:23]([NH:26][C:27]([C:28](=[O:29])[NH:30][CH2:31][CH2:32][c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)=[O:39])[cH:24][cH:25]3)[cH:14][cH:15][n:16][c:17]2[cH:18]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 887MethanolHCID 961Hydroxide2×HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 57810393N1-[3-Fluoro-4-[[6-methoxy-7-(phenylmethoxy)-4-quinolinyl]oxy]phenyl]-N2-(2-phenylethyl)ethanediamide

Product 1

HCID 136168658HCID 136168658, compound

Sources & evidence

ORD record
ord-e3269b90765a416cb39eb9b5c177268c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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