Acetate → HCID 59238965, compound

HRID 1137985Notes

Reaction equation

HRID 1137985 reaction equation
[Br:1][c:2]1[c:3]2[c:4]([c:5]([O:16][CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[c:6]3[nH:7][c:8]4[cH:9][cH:10][c:11]([F:15])[cH:12][c:13]4[c:14]13)[nH:22][c:23]1[cH:24][cH:25][c:26]([F:29])[cH:27][c:28]21.[CH2:30]1[CH2:31][CH2:32][NH:33][CH2:34]1.[CH3:81][C:82]([CH3:83])([O-:84])[CH3:85].[CH3:87][c:88]1[cH:89][cH:90][cH:91][cH:92][cH:93]1.[Na+:86].[O-:95][C:96]([CH3:97])=[O:98].[O-:99][C:100]([CH3:101])=[O:102].[Pd+2:94].[cH:35]1[cH:36][cH:37][c:38]([P:39]([c:40]2[cH:41][cH:42][c:43]3[c:44]([cH:45][cH:46][cH:47][cH:48]3)[c:49]2-[c:50]2[c:51]3[c:52]([cH:53][cH:54][cH:55][cH:56]3)[cH:57][cH:58][c:59]2[P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80]1>>[c:2]1([N:33]2[CH2:32][CH2:31][CH2:30][CH2:34]2)[c:3]2[c:4]([c:5]([O:16][CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[c:6]3[nH:7][c:8]4[cH:9][cH:10][c:11]([F:15])[cH:12][c:13]4[c:14]13)[nH:22][c:23]1[cH:24][cH:25][c:26]([F:29])[cH:27][c:28]21

Participants

9

Reactant 8

HCID 175Acetate2×HCID 923Sodium ionHCID 1140TolueneHCID 31268PyrrolidineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 45749132-Methylpropan-2-olateHCID 59238889HCID 59238889, compound

Product 1

HCID 59238965HCID 59238965, compound

Sources & evidence

ORD record
ord-1367c379900c4160aefb4b4918893ba1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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