Water → HCID 178498228, compound

HRID 1118982Notes

Reaction equation

HRID 1118982 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][c:8]1[cH:9][c:10]([N+:23](=[O:24])[O-:25])[cH:11][c:12]([B:14]2[O:15][C:16]([CH3:17])([CH3:18])[C:19]([CH3:20])([CH3:21])[O:22]2)[cH:13]1)([CH3:26])[CH3:27].[C:47](=[O:48])([O-:49])[O-:50].[CH3:28][O:29][C:30](=[O:31])[CH:32]1[C:33]([CH3:45])([CH3:46])[CH2:34][C:35]([OH:38])([c:39]2[s:40][c:41]([Br:44])[cH:42][n:43]2)[CH2:36][CH2:37]1.[CH:53]1([P:54]([CH:55]2[CH2:56][CH2:57][CH2:58][CH2:59][CH2:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][c:66]2-[c:67]2[c:68]([CH:69]([CH3:70])[CH3:71])[cH:72][c:73]([CH:74]([CH3:75])[CH3:76])[cH:77][c:78]2[CH:79]([CH3:80])[CH3:81])[CH2:82][CH2:83][CH2:84][CH2:85][CH2:86]1.[Cs+:51].[Cs+:52].[O:114]=[C:115]([CH:116]=[CH:117][c:118]1[cH:119][cH:120][cH:121][cH:122][cH:123]1)[CH:124]=[CH:125][c:126]1[cH:127][cH:128][cH:129][cH:130][cH:131]1.[O:132]=[C:133]([CH:134]=[CH:135][c:136]1[cH:137][cH:138][cH:139][cH:140][cH:141]1)[CH:142]=[CH:143][c:144]1[cH:145][cH:146][cH:147][cH:148][cH:149]1.[O:87]1[CH2:88][CH2:89][O:90][CH2:91][CH2:92]1.[O:96]=[C:97]([CH:98]=[CH:99][c:100]1[cH:101][cH:102][cH:103][cH:104][cH:105]1)[CH:106]=[CH:107][c:108]1[cH:109][cH:110][cH:111][cH:112][cH:113]1.[OH2:93].[Pd:94].[Pd:95]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([O:6][CH2:7][c:8]1[cH:9][c:10]([N+:23](=[O:24])[O-:25])[cH:11][c:12](-[c:41]2[s:40][c:39]([C:35]3([OH:38])[CH2:34][C:33]([CH3:45])([CH3:46])[CH:32]([C:30]([O:29][CH3:28])=[O:31])[CH2:37][CH2:36]3)[n:43][cH:42]2)[cH:13]1)([CH3:26])[CH3:27]

Participants

10

Reactant 9

HCID 962WaterHCID 19660Carbonate IonHCID 23938Palladium2×HCID 312751,4-DioxaneHCID 95417Dibenzylidene acetone3×HCID 104967Cesium cation2×HCID 111557942-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenylHCID 67429606Methyl 4-(5-bromo-1,3-thiazol-2-yl)-4-hydroxy-2,2-dimethylcyclohexane-1-carboxylateHCID 67433819Tert-butyl(dimethyl){[3-nitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl]oxy}silane

Product 1

HCID 178498228HCID 178498228, compound

Sources & evidence

ORD record
ord-ce53745bcd514520a36c8cc0318942b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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