Toluene → HCID 46831647, compound

HRID 665748Notes

Reaction equation

HRID 665748 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[OH:20])[CH2:11][CH2:12]1.[C:43](=[O:44])([O-:45])[O-:46].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[Cl:56][CH2:57][Cl:58].[Cs+:47].[Cs+:48].[Cu:59][I:60].[I:21][c:22]1[c:23]([CH3:28])[cH:24][cH:25][cH:26][cH:27]1.[cH:29]1[cH:30][c:31]2[cH:32][cH:33][c:34]3[c:35]([c:36]2[n:37][cH:38]1)[n:39][cH:40][cH:41][cH:42]3>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[O:20][c:22]2[c:23]([CH3:28])[cH:24][cH:25][cH:26][cH:27]2)[CH2:11][CH2:12]1

Participants

9

Reactant 8

HCID 1140TolueneHCID 13181,10-PhenanthrolineHCID 51282-IodotolueneHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 104967Cesium cation2×HCID 46831646tert-Butyl 3-(hydroxy(phenyl)methyl)pyrrolidine-1-carboxylate

Product 1

HCID 46831647HCID 46831647, compound

Sources & evidence

ORD record
ord-c2a48bb71b814357abba29e59e664e86
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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