Toluene → HCID 68802894, compound

HRID 312437Notes

Reaction equation

HRID 312437 reaction equation
[CH2:29]([Al+:30][CH2:31][CH:32]([CH3:33])[CH3:34])[CH:35]([CH3:36])[CH3:37].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6]1[n:7][c:8]([CH:25]([CH3:26])[CH3:27])[c:9]([CH:18]=[CH:19][C:20](=[O:21])[O:22][CH2:23][CH3:24])[c:10]2-[c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1.[H-:28]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6]1[n:7][c:8]([CH:25]([CH3:26])[CH3:27])[c:9]([CH:18]=[CH:19][CH2:20][OH:21])[c:10]2-[c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 166653HydrideHCID 16686348Bis(2-methylpropyl)alumanyliumHCID 69526455HCID 69526455, compound

Product 1

HCID 68802894HCID 68802894, compound

Sources & evidence

ORD record
ord-679cf072c1b74a4fa6265ddcfd02364d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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