Toluene → HCID 86654333, compound

HRID 190409Notes

Reaction equation

HRID 190409 reaction equation
[CH2:1]1[CH2:2][O:3][CH:4]=[CH:5][CH2:6]1.[CH3:18][O:19][P:20]([O:21][CH3:22])(=[O:23])[CH:24]([OH:25])[c:26]1[cH:27][c:28]([C:32]#[N:33])[cH:29][cH:30][cH:31]1.[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[c:7]1([CH3:8])[cH:9][cH:10][c:11]([S:12]([OH:13])(=[O:14])=[O:15])[cH:16][cH:17]1>>[CH2:1]1[CH2:2][O:3][CH:4]([O:25][CH:24]([P:20]([O:19][CH3:18])([O:21][CH3:22])=[O:23])[c:26]2[cH:27][c:28]([C:32]#[N:33])[cH:29][cH:30][cH:31]2)[CH2:5][CH2:6]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 80803,4-dihydro-2H-pyranHCID 86654332(3-Cyanophenyl-hydroxy-methyl]-phosphonic acid dimethyl ester

Product 1

HCID 86654333HCID 86654333, compound

Sources & evidence

ORD record
ord-1da9c2aa7a2840a5b822b5f9fdd20753
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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