Ethanol → 2-(4-Methylphenyl)furan

HRID 125147

Reaction equation

HRID 125147 reaction equation
[Br:11][c:12]1[o:13][cH:14][cH:15][cH:16]1.[CH2:17]([CH2:18][O:19][CH3:20])[O:21][CH3:22].[CH3:107][CH2:108][OH:109].[Na+:23].[Na+:24].[O-:25][C:26](=[O:27])[O-:28].[OH2:106].[c:1]1([CH3:10])[cH:2][cH:3][c:4]([B:7]([OH:8])[OH:9])[cH:5][cH:6]1.[cH:29]1[cH:30][cH:31][c:32]([P:33]([Pd:34]([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)([c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[cH:104][cH:105]1>>[c:1]1([CH3:10])[cH:2][cH:3][c:4](-[c:12]2[o:13][cH:14][cH:15][cH:16]2)[cH:5][cH:6]1

Participants

9

Reactant 8

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 79799Tolylboronic acidHCID 2776190Furan, 2-bromo-HCID 178420554HCID 178420554, compound

Product 1

HCID 113895372-(4-Methylphenyl)furan

Sources & evidence

ORD record
ord-9fff84d55686462d92cd723fadba9309
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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