Toluene → HCID 86620751, compound

HRID 199548Notes

Reaction equation

HRID 199548 reaction equation
[CH2:29]([Al+:30][CH2:31][CH:32]([CH3:33])[CH3:34])[CH:35]([CH3:36])[CH3:37].[CH3:38][N+:39]1([O-:45])[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Cl:1][c:2]1[c:3]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[c:4]([CH3:22])[n:5]([S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[H-:28]>>[Cl:1][c:2]1[c:3]([CH:23]=[O:24])[c:4]([CH3:22])[n:5]([S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 82029Methyl morpholine oxideHCID 166653HydrideHCID 16686348Bis(2-methylpropyl)alumanyliumHCID 66924673HCID 66924673, compound

Product 1

HCID 86620751HCID 86620751, compound

Sources & evidence

ORD record
ord-755123ffade04b7ba5bb75505061ea17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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