Toluene → HCID 20227416, compound

HRID 307070Notes

Reaction equation

HRID 307070 reaction equation
[Al+3:28].[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[F:1][c:2]1[c:3]([O:14][CH3:15])[cH:4][c:5]([CH:8]2[CH2:9][NH:10][CH2:11][CH2:12][CH2:13]2)[cH:6][cH:7]1.[H-:27].[H-:30].[H-:31].[H-:32].[Li+:29].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[c:16]1([CH2:22][CH2:23][C:24]([Cl:25])=[O:26])[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[F:1][c:2]1[c:3]([O:14][CH3:15])[cH:4][c:5]([CH:8]2[CH2:9][N:10]([CH2:24][CH2:23][CH2:22][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[CH2:11][CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 1140TolueneHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 64801Benzenepropanoyl chlorideHCID 104727Aluminum CationHCID 166653Hydride4×HCID 20227422HCID 20227422, compound

Product 1

HCID 20227416HCID 20227416, compound

Sources & evidence

ORD record
ord-60e6b6437b9e4e17aa1522e768485957
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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