Toluene → HCID 10934578, compound

HRID 1575130Notes

Reaction equation

HRID 1575130 reaction equation
[CH2:22]([Al+:23][CH2:24][CH:25]([CH3:26])[CH3:27])[CH:28]([CH3:29])[CH3:30].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Cl:1][c:2]1[o:3][c:4]([CH2:14][CH2:15][C:16](=[O:17])[O:18][CH2:19][CH3:20])[c:5](-[c:7]2[cH:8][cH:9][c:10]([Cl:13])[cH:11][cH:12]2)[n:6]1.[H-:21].[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1>>[Cl:1][c:2]1[o:3][c:4]([CH2:14][CH2:15][CH2:16][OH:17])[c:5](-[c:7]2[cH:8][cH:9][c:10]([Cl:13])[cH:11][cH:12]2)[n:6]1

Participants

6

Sources & evidence

ORD record
ord-6d27f01691f74d6583195cef40bd7368
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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