Toluene → HCID 178491503, compound

HRID 2334130Notes

Reaction equation

HRID 2334130 reaction equation
[CH3:21][O:22][c:23]1[cH:24][cH:25][c:26]([CH2:27][OH:28])[cH:29][cH:30]1.[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH3:38][CH2:39][O-:40].[CH3:41][CH2:42][O-:43].[CH3:44][CH2:45][O-:46].[CH3:47][CH2:48][O-:49].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:11]1[N:10]([CH3:12])[O:9][CH:8]1[C:7]2([OH:20])[CH2:15][CH:14]([C:16](=[O:17])[O:18][CH3:19])[NH:13]1.[Ti+4:50]>>[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:11]1[N:10]([CH3:12])[O:9][CH:8]1[C:7]2([OH:20])[CH2:15][CH:14]([C:16](=[O:17])[O:18][CH2:19][c:26]2[cH:25][cH:24][c:23]([O:22][CH3:21])[cH:30][cH:29]2)[NH:13]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 77384-Methoxybenzyl alcoholHCID 114942Titanium cation (4+)HCID 1194401-Hydroxyethyl radical4×HCID 178497022HCID 178497022, compound

Product 1

HCID 178491503HCID 178491503, compound

Sources & evidence

ORD record
ord-315392f909e34c7ca27ddc1e38450cb1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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