Acetate → HCID 44230454, compound

HRID 2336803Notes

Reaction equation

HRID 2336803 reaction equation
[C:76]([O-:77])(=[O:78])[CH3:79].[C:81]([O-:82])(=[O:83])[CH3:84].[CH3:69][c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1.[CH:32]1([P:33]([CH:34]2[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][c:45]2-[c:46]2[c:47]([O:48][CH3:49])[cH:50][cH:51][cH:52][c:53]2[O:54][CH3:55])[CH2:56][CH2:57][CH2:58][CH2:59][CH2:60]1.[Cl:1][c:2]1[n:3][c:4]2[n:5]([cH:6][c:7](-[c:10]3[cH:11][c:12]([CH2:16][OH:17])[cH:13][cH:14][cH:15]3)[cH:8][cH:9]2)[cH:18]1.[K+:66].[K+:67].[K+:68].[P:61]([O-:62])([O-:63])([O-:64])=[O:65].[Pd+2:80].[n:19]1[cH:20][c:21]([B:29]([OH:30])[OH:31])[cH:22][c:23]2[cH:24][cH:25][cH:26][cH:27][c:28]12>>[c:2]1(-[c:21]2[cH:20][n:19][c:28]3[c:23]([cH:22]2)[cH:24][cH:25][cH:26][cH:27]3)[n:3][c:4]2[n:5]([cH:6][c:7](-[c:10]3[cH:11][c:12]([CH2:16][OH:17])[cH:13][cH:14][cH:15]3)[cH:8][cH:9]2)[cH:18]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 2734663Quinoline-3-boronic acidHCID 112698722-Dicyclohexylphosphino-2',6'-dimethoxybiphenylHCID 44232374HCID 44232374, compound

Product 1

HCID 44230454HCID 44230454, compound

Sources & evidence

ORD record
ord-7f1261d7a12d433780606e3fafa70d3b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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