Hydrochloric Acid → HCID 58016826, compound

HRID 147324Notes

Reaction equation

HRID 147324 reaction equation
[Br:32][CH2:33][C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40].[CH2:54]([N+:55]([CH2:56][CH2:57][CH2:58][CH3:59])([CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH2:66][CH3:67])[CH2:68][CH2:69][CH3:70].[CH3:3][O:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[o:13][c:14]3[n:15][cH:16][n:17][c:18]([O:20][CH2:21][CH:22]([CH2:23][OH:24])[CH3:25])[c:19]23)[cH:9][cH:10]1.[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[ClH:41].[Na+:2].[OH-:1].[S:49]([O-:50])([OH:51])(=[O:52])=[O:53]>>[CH3:3][O:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[o:13][c:14]3[n:15][cH:16][n:17][c:18]([O:20][CH2:21][CH:22]([CH2:23][O:24][CH2:33][C:34](=[O:35])[O:36][C:37]([CH3:38])([CH3:39])[CH3:40])[CH3:25])[c:19]23)[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 1140TolueneHCID 16028TetrabutylammoniumHCID 61778Sulfate, hydrogenHCID 79177tert-Butyl bromoacetateHCID 58016956HCID 58016956, compound

Product 1

HCID 58016826HCID 58016826, compound

Sources & evidence

ORD record
ord-8a25bc24918d49548595e1586a37cdcf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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