Ammonium → HCID 59857454, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:7][c:8]2[n:9][cH:10][cH:11][cH:12][c:13]2[I:14])[cH:15][cH:16][cH:17][cH:18]1.[CH3:39][C:40]([CH3:41])([O-:42])[CH3:43].[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[CH:19]([CH3:20])([CH3:21])[Si:22]([n:23]1[cH:24][cH:25][c:26]2[cH:27][c:28]([NH2:32])[cH:29][n:30][c:31]12)([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38].[Cl-:45].[Fe+2:90].[NH4+:46].[Na+:44].[O:111]=[C:112]([CH:113]=[CH:114][c:115]1[cH:116][cH:117][cH:118][cH:119][cH:120]1)[CH:121]=[CH:122][c:123]1[cH:124][cH:125][cH:126][cH:127][cH:128]1.[O:129]=[C:130]([CH:131]=[CH:132][c:133]1[cH:134][cH:135][cH:136][cH:137][cH:138]1)[CH:139]=[CH:140][c:141]1[cH:142][cH:143][cH:144][cH:145][cH:146]1.[O:93]=[C:94]([CH:95]=[CH:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1)[CH:103]=[CH:104][c:105]1[cH:106][cH:107][cH:108][cH:109][cH:110]1.[Pd:91].[Pd:92].[cH:54]1[cH:55][cH:56][c:57]([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c-:65]2[cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71]1.[cH:72]1[cH:73][cH:74][c:75]([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c-:83]2[cH:84][cH:85][cH:86][cH:87]2)[cH:88][cH:89]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:7][c:8]2[n:9][cH:10][cH:11][cH:12][c:13]2[NH:32][c:28]2[cH:27][c:26]3[cH:25][cH:24][n:23]([Si:22]([CH:19]([CH3:20])[CH3:21])([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38])[c:31]3[n:30][cH:29]2)[cH:15][cH:16][cH:17][cH:18]1Participants
12
Reactant 11
HCID 223Ammonium
HCID 312Chloride
HCID 923Sodium ion
HCID 1140Toluene
HCID 23938Palladium2×
HCID 27284Ferrous cation
HCID 95417Dibenzylidene acetone3×
HCID 45749132-Methylpropan-2-olate
HCID 222736141-[Tri(propan-2-yl)silyl]-1H-pyrrolo[2,3-b]pyridin-5-amine
HCID 598574352-(2-tert-Butylphenoxy)-3-iodopyridine
HCID 178420532HCID 178420532, compound2×Product 1
Sources & evidence
- ORD record
- ord-6c2eb8660bfb4babb25d7c3cbb7f079d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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