Sodium ion → HCID 23067331, compound

HRID 308941Notes

Reaction equation

[C:53]([P:54]([C:55]([CH3:56])([CH3:57])[CH3:58])[C:59]([CH3:60])([CH3:61])[CH3:62])([CH3:63])([CH3:64])[CH3:65].[CH3:66][C:67]([CH3:68])([O-:69])[CH3:70].[CH3:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]3[cH:10][cH:11][cH:12][cH:13][c:14]3[c:15](-[c:22]3[cH:23][c:24](-[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:25][c:26](-[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[cH:27]3)[c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]23)[cH:6][cH:7]1.[NH:40]([c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)[c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Na+:71].[O:117]=[C:118]([CH:119]=[CH:120][c:121]1[cH:122][cH:123][cH:124][cH:125][cH:126]1)[CH:127]=[CH:128][c:129]1[cH:130][cH:131][cH:132][cH:133][cH:134]1.[O:81]=[C:82]([CH:83]=[CH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1)[CH:91]=[CH:92][c:93]1[cH:94][cH:95][cH:96][cH:97][cH:98]1.[O:99]=[C:100]([CH:101]=[CH:102][c:103]1[cH:104][cH:105][cH:106][cH:107][cH:108]1)[CH:109]=[CH:110][c:111]1[cH:112][cH:113][cH:114][cH:115][cH:116]1.[Pd:79].[Pd:80]>>[c:2]1([N:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:3][cH:4][c:5](-[c:8]2[c:9]3[cH:10][cH:11][cH:12][cH:13][c:14]3[c:15](-[c:22]3[cH:23][c:24](-[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:25][c:26](-[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[cH:27]3)[c:16]3[cH:17][cH:18][cH:19][cH:20][c:21]23)[cH:6][cH:7]1

Participants

Reactant 8

HCID 923Sodium ion

HCID 1140Toluene

HCID 11487Diphenylamine

HCID 23938Palladium2×

HCID 83681Tris(1,1-dimethylethyl)phosphine

HCID 95417Dibenzylidene acetone3×

HCID 45749132-Methylpropan-2-olate

HCID 23067327HCID 23067327, compound

Product 1

HCID 23067331HCID 23067331, compound

Sources & evidence

ORD record: ord-360f6f864b0149b9a51e6dfd76bded15
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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