Acetate → HCID 69242242, compound

HRID 2128525Notes

Reaction equation

HRID 2128525 reaction equation
[Br:1][c:2]1[cH:3][c:4]([N+:9](=[O:10])[O-:11])[c:5]([CH3:8])[cH:6][cH:7]1.[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[O:19][c:20]1[c:21]([B:26]([OH:27])[OH:28])[cH:22][cH:23][cH:24][cH:25]1.[CH2:64]1[O:65][CH2:66][CH2:67][CH2:68]1.[K+:34].[K+:35].[K+:36].[N:37]#[N:38].[O-:70][C:71]([CH3:72])=[O:73].[O-:74][C:75]([CH3:76])=[O:77].[P:29]([O-:30])([O-:31])([O-:32])=[O:33].[Pd+2:69].[c:39]1(-[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][c:50]1[P:51]([CH:52]1[CH2:53][CH2:54][CH2:55][CH2:56][CH2:57]1)[CH:58]1[CH2:59][CH2:60][CH2:61][CH2:62][CH2:63]1>>[c:2]1(-[c:21]2[c:20]([O:19][CH2:12][c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[cH:25][cH:24][cH:23][cH:22]2)[cH:3][c:4]([N+:9](=[O:10])[O-:11])[c:5]([CH3:8])[cH:6][cH:7]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 947NitrogenHCID 1061PhosphateHCID 8028TetrahydrofuranHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 1235464-Bromo-2-nitrotolueneHCID 27342162-(Dicyclohexylphosphino)biphenylHCID 2773253(2-(Benzyloxy)phenyl)boronic acid

Product 1

HCID 69242242HCID 69242242, compound

Sources & evidence

ORD record
ord-30a16e548aaf4b6ba343658394ca2bba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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