Chloride → Methyl 4-(oxazol-2-yl)benzoate

HRID 2336156Notes

Reaction equation

HRID 2336156 reaction equation
[CH2:22]1[O:23][CH2:24][CH2:25][CH2:26]1.[CH2:6]([Li:7])[CH2:8][CH2:9][CH3:10].[CH3:11][O:12][C:13]([c:14]1[cH:15][cH:16][c:17]([Br:20])[cH:18][cH:19]1)=[O:21].[CH3:27][CH2:28][O:29][C:30](=[O:31])[CH3:32].[Cl-:33].[Cl-:35].[Pd:36]([Cl:37])[Cl:38].[Zn+2:34].[c:39]1([P:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:53][cH:54][cH:55][cH:56][cH:57]1.[c:58]1([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[cH:72][cH:73][cH:74][cH:75][cH:76]1.[o:1]1[cH:2][n:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:17]2[cH:16][cH:15][c:14]([C:13]([O:12][CH3:11])=[O:21])[cH:19][cH:18]2)[n:3][cH:4][cH:5]1

Participants

10

Reactant 9

HCID 312Chloride2×HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 9255OxazoleHCID 11776Triphenylphosphine2×HCID 12081Methyl 4-bromobenzoateHCID 24290Palladium ChlorideHCID 32051Zinc(2+)HCID 178418339Butyllithium

Product 1

HCID 21985208Methyl 4-(oxazol-2-yl)benzoate

Sources & evidence

ORD record
ord-725bbcc8ed214579b586839cb292d02a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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