Sodium ion → HCID 72472850, compound

HRID 294654Notes

Reaction equation

HRID 294654 reaction equation
[Br:1][CH2:2][C:3](=[O:4])[O:5][C:6]([CH3:7])([CH3:8])[CH3:9].[C:12]([O:13][CH3:14])([CH3:15])([CH3:16])[CH3:17].[CH2:38]([N+:39]([CH2:40][CH2:41][CH2:42][CH3:43])([CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH3:54].[CH2:56]([N+:57]([CH2:58][CH2:59][CH2:60][CH3:61])([CH2:62][CH2:63][CH2:64][CH3:65])[CH2:66][CH2:67][CH2:68][CH3:69])[CH2:70][CH2:71][CH3:72].[CH3:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[I-:55].[Na+:11].[O:18]1[CH:19]([O:24][CH:25]2[CH2:26][CH:27]([CH2:31][OH:32])[CH2:28][CH2:29][CH2:30]2)[CH2:20][CH2:21][CH2:22][CH2:23]1.[OH-:10].[OH2:80].[S:33](=[O:34])(=[O:35])([OH:36])[O-:37]>>[CH2:2]([C:3](=[O:4])[O:5][C:6]([CH3:7])([CH3:8])[CH3:9])[O:32][CH2:31][CH:27]1[CH2:26][CH:25]([O:24][CH:19]2[O:18][CH2:23][CH2:22][CH2:21][CH2:20]2)[CH2:30][CH2:29][CH2:28]1

Participants

11

Reactant 10

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 15413tert-Butyl methyl etherHCID 16028Tetrabutylammonium2×HCID 30165Iodide IonHCID 61778Sulfate, hydrogenHCID 79177tert-Butyl bromoacetateHCID 68903321HCID 68903321, compound

Product 1

HCID 72472850HCID 72472850, compound

Sources & evidence

ORD record
ord-2840c66297364150a78b804597aac02f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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