Benzene → (4-Methoxy-2-methylphenyl)(4-methoxyphenyl)methanone

HRID 2140523Notes

Reaction equation

HRID 2140523 reaction equation
[Al+3:69].[C:10]([c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1)(=[O:19])[Cl:20].[CH2:40]([OH:41])[C:42]#[CH:43].[CH3:1][c:2]1[cH:3][c:4]([O:8][CH3:9])[cH:5][cH:6][cH:7]1.[CH3:78][CH2:79][CH2:80][CH2:81][CH2:82][CH3:83].[Cl-:68].[Cl-:70].[Cl-:71].[F:21][c:22]1[cH:23][cH:24][cH:25][cH:26][c:27]1[C:28]([c:29]1[cH:30][cH:31][c:32]([O:33][CH3:34])[c:35]([O:36][CH3:37])[cH:38]1)=[O:39].[Na+:67].[OH-:66].[OH:44][c:45]1[cH:46][c:47]2[c:48]([cH:49][cH:50][cH:51][cH:52]2)[cH:53][cH:54]1.[c:55]1([CH3:56])[cH:57][cH:58][c:59]([S:60]([OH:61])(=[O:62])=[O:63])[cH:64][cH:65]1.[cH:72]1[cH:73][cH:74][cH:75][cH:76][cH:77]1>>[CH3:1][c:2]1[cH:3][c:4]([O:8][CH3:9])[cH:5][cH:6][c:7]1[C:10]([c:11]1[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1)=[O:19]

Participants

13

Reactant 12

HCID 241BenzeneHCID 312Chloride3×HCID 923Sodium ionHCID 961HydroxideHCID 6101p-Toluenesulfonic acidHCID 7477p-Anisoyl chlorideHCID 75303-MethoxytolueneHCID 7859Propargyl alcoholHCID 8058HexaneHCID 86632-NaphtholHCID 104727Aluminum CationHCID 14297443HCID 14297443, compound

Product 1

HCID 19905784(4-Methoxy-2-methylphenyl)(4-methoxyphenyl)methanone

Sources & evidence

ORD record
ord-64b479f11b9d4ce5af83b4683f55111f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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