Acetate → HCID 178430346, compound

HRID 1571047Notes

Reaction equation

HRID 1571047 reaction equation
[C:104]([O-:105])(=[O:106])[CH3:107].[C:47](=[O:48])([O-:49])[O-:50].[C:99]([O-:100])(=[O:101])[CH3:102].[Cl:61][c:62]1[cH:63][cH:64][c:65]([C:68](=[O:69])[N:70]([c:71]2[cH:72][cH:73][c:74]([CH2:77][N:78]3[CH2:79][CH:80]([CH3:91])[N:81]([C:84](=[O:85])[O:86][C:87]([CH3:88])([CH3:89])[CH3:90])[CH2:82][CH2:83]3)[cH:75][cH:76]2)[CH3:92])[cH:66][n:67]1.[Cs+:51].[Cs+:52].[NH2:53][c:54]1[cH:55][cH:56][c:57]([F:58])[cH:59][cH:60]1.[O:93]1[CH2:94][CH2:95][O:96][CH2:97][CH2:98]1.[Pd+2:103].[cH:1]1[cH:2][cH:3][c:4]([P:5]([c:6]2[cH:7][cH:8][c:9]3[c:10]([cH:11][cH:12][cH:13][cH:14]3)[c:15]2-[c:16]2[c:17]3[c:18]([cH:19][cH:20][cH:21][cH:22]3)[cH:23][cH:24][c:25]2[P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:45][cH:46]1>>[NH:53]([c:54]1[cH:55][cH:56][c:57]([F:58])[cH:59][cH:60]1)[c:62]1[cH:63][cH:64][c:65]([C:68](=[O:69])[N:70]([c:71]2[cH:72][cH:73][c:74]([CH2:77][N:78]3[CH2:79][CH:80]([CH3:91])[N:81]([C:84](=[O:85])[O:86][C:87]([CH3:88])([CH3:89])[CH3:90])[CH2:82][CH2:83]3)[cH:75][cH:76]2)[CH3:92])[cH:66][n:67]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 97314-FluoroanilineHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 178430335HCID 178430335, compound

Product 1

HCID 178430346HCID 178430346, compound

Sources & evidence

ORD record
ord-223efc1c6c484ed5ae6d6dff80c3111a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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