Acetate → HCID 23081199, compound

HRID 156499Notes

Reaction equation

HRID 156499 reaction equation
[Br:18][c:19]1[cH:20][cH:21][c:22]([O:23][CH:24]2[O:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[cH:30][cH:31]1.[C:91]([O-:92])(=[O:93])[CH3:94].[C:96]([O-:97])(=[O:98])[CH3:99].[CH3:101][CH2:102][O:103][C:104](=[O:105])[CH3:106].[CH3:78][C:79]([CH3:80])([O-:81])[CH3:82].[CH3:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1.[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[cH:8][cH:9]1)([F:16])[F:17].[Na+:83].[OH2:100].[Pd+2:95].[cH:32]1[cH:33][cH:34][c:35]([P:36]([c:37]2[cH:38][cH:39][c:40]3[c:41]([cH:42][cH:43][cH:44][cH:45]3)[c:46]2-[c:47]2[c:48]3[c:49]([cH:50][cH:51][cH:52][cH:53]3)[cH:54][cH:55][c:56]2[P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[cH:76][cH:77]1>>[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][N:13]([c:19]3[cH:20][cH:21][c:22]([O:23][CH:24]4[O:25][CH2:26][CH2:27][CH2:28][CH2:29]4)[cH:30][cH:31]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1)([F:16])[F:17]

Participants

11

Reactant 10

HCID 175Acetate2×HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 8857Ethyl AcetateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 45749132-Methylpropan-2-olateHCID 46464362-(4-Bromophenoxy)tetrahydro-2H-pyranHCID 230811701-(4-(Trifluoromethoxy)phenyl)piperazine

Product 1

HCID 23081199HCID 23081199, compound

Sources & evidence

ORD record
ord-a82072c8b127418a9b7c81540a2bef14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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