Toluene → HCID 86595318, compound

HRID 165110Notes

Reaction equation

HRID 165110 reaction equation
[BH:16]([OH:17])[OH:18].[CH3:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]#[C:9][c:10]2[n:11][c:12]([CH3:15])[nH:13][cH:14]2)[cH:7]1>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([C:8]#[C:9][c:10]2[n:11][c:12]([CH3:15])[n:13](-[c:23]3[cH:22][cH:21][c:20]([CH3:19])[cH:25][cH:24]3)[cH:14]2)[cH:7]1

Participants

4

Sources & evidence

ORD record
ord-c2a7be323a4941169834bb06b6471318
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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