Acetate → HCID 178442134, compound

HRID 126028Notes

Reaction equation

HRID 126028 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([CH3:6])([CH3:7])[O:8][CH:9]([C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:14][CH2:15][c:16]1[c:17]([CH3:43])[cH:18][c:19]([C:22]([CH2:23][CH3:24])([c:25]2[cH:26][c:27]([CH3:40])[c:28]([B:31]3[O:32][C:33]([CH3:34])([CH3:35])[C:36]([CH3:37])([CH3:38])[O:39]3)[cH:29][cH:30]2)[CH2:41][CH3:42])[cH:20][cH:21]1.[CH3:101][c:102]1[cH:103][cH:104][cH:105][cH:106][cH:107]1.[CH3:109][CH2:110][O:111][CH2:112][CH3:113].[CH3:81][O:82][C:83]([CH:84]([c:85]1[cH:86][cH:87][c:88]([Cl:91])[cH:89][cH:90]1)[NH:92][C:93](=[O:94])[O:95][C:96]([CH3:97])([CH3:98])[CH3:99])=[O:100].[CH:44]1([P:45]([CH:46]2[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][c:57]2-[c:58]2[c:59]([O:60][CH3:61])[cH:62][cH:63][cH:64][c:65]2[O:66][CH3:67])[CH2:68][CH2:69][CH2:70][CH2:71][CH2:72]1.[K+:78].[K+:79].[K+:80].[O-:115][C:116]([CH3:117])=[O:118].[O-:119][C:120]([CH3:121])=[O:122].[OH2:108].[P:73]([O-:74])([O-:75])([O-:76])=[O:77].[Pd+2:114]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[Si:5]([CH3:6])([CH3:7])[O:8][CH:9]([C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:14][CH2:15][c:16]1[c:17]([CH3:43])[cH:18][c:19]([C:22]([CH2:23][CH3:24])([c:25]2[cH:26][c:27]([CH3:40])[c:28](-[c:88]3[cH:87][cH:86][c:85]([CH:84]([C:83]([O:82][CH3:81])=[O:100])[NH:92][C:93](=[O:94])[O:95][C:96]([CH3:97])([CH3:98])[CH3:99])[cH:90][cH:89]3)[cH:29][cH:30]2)[CH2:41][CH3:42])[cH:20][cH:21]1

Participants

11

Reactant 10

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 1140TolueneHCID 3283Diethyl EtherHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 112698722-Dicyclohexylphosphino-2',6'-dimethoxybiphenylHCID 577089262-[4-(1-{4-[3-(t-Butyldimethyl-silanyloxy)-4,4-dimethyl-pentyl]-3-methyl-phenyl}-1-ethyl-propyl)-2-methyl-phenyl]-4,4,5,5-tetramethyl-[1,3,2]dioxaborolaneHCID 67065142Methyl 2-((tert-butoxycarbonyl)amino)-2-(4-chlorophenyl)acetate

Product 1

HCID 178442134HCID 178442134, compound

Sources & evidence

ORD record
ord-c7edd963a0044373a92e3048cbb1eaa3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…