Acetate → HCID 58508759, compound

HRID 2152599Notes

Reaction equation

HRID 2152599 reaction equation
[CH3:1][C:2]1([CH3:3])[C:4]([CH3:5])([CH3:6])[O:7][B:8]([c:9]2[cH:10][cH:11][n:12][cH:13][cH:14]2)[O:15]1.[CH3:91][c:92]1[cH:93][cH:94][cH:95][cH:96][cH:97]1.[CH:24]1([P:25]([CH:26]2[CH2:27][CH2:28][CH2:29][CH2:30][CH2:31]2)[c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]2-[c:38]2[c:39]([O:40][CH3:41])[cH:42][cH:43][cH:44][c:45]2[O:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH2:51][CH2:52]1.[Cl:53][c:54]1[cH:55][cH:56][c:57]([C:60](=[O:61])[NH:62][c:63]2[c:64]([C:65](=[O:66])[O:67][C:68]([CH3:69])([CH3:70])[CH3:71])[cH:72][cH:73][c:74](-[c:76]3[cH:77][cH:78][cH:79][cH:80][cH:81]3)[cH:75]2)[cH:58][n:59]1.[K+:21].[K+:22].[K+:23].[O-:83][C:84]([CH3:85])=[O:86].[O-:87][C:88]([CH3:89])=[O:90].[P:16]([O-:17])([O-:18])([O-:19])=[O:20].[Pd+2:82]>>[c:9]1(-[c:54]2[cH:55][cH:56][c:57]([C:60](=[O:61])[NH:62][c:63]3[c:64]([C:65](=[O:66])[O:67][C:68]([CH3:69])([CH3:70])[CH3:71])[cH:72][cH:73][c:74](-[c:76]4[cH:77][cH:78][cH:79][cH:80][cH:81]4)[cH:75]3)[cH:58][n:59]2)[cH:10][cH:11][n:12][cH:13][cH:14]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 1061PhosphateHCID 1140TolueneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27346484-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridineHCID 112698722-Dicyclohexylphosphino-2',6'-dimethoxybiphenylHCID 58508530HCID 58508530, compound

Product 1

HCID 58508759HCID 58508759, compound

Sources & evidence

ORD record
ord-e1ec0bce9b5c4e5f83886afc3035599b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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