Hydrochloric Acid → HCID 58016786, compound

HRID 125693Notes

Reaction equation

HRID 125693 reaction equation
[Br:33][CH2:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41].[CH2:55]([N+:56]([CH2:57][CH2:58][CH2:59][CH3:60])([CH2:61][CH2:62][CH2:63][CH3:64])[CH2:65][CH2:66][CH2:67][CH3:68])[CH2:69][CH2:70][CH3:71].[CH3:3][O:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[o:13][c:14]3[n:15][cH:16][n:17][c:18]([O:20][CH:21]([CH2:22][CH:23]([CH3:24])[OH:25])[CH3:26])[c:19]23)[cH:9][cH:10]1.[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[ClH:42].[Na+:2].[OH-:1].[S:50]([O-:51])([OH:52])(=[O:53])=[O:54]>>[CH3:3][O:4][c:5]1[cH:6][cH:7][c:8](-[c:11]2[c:12](-[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[o:13][c:14]3[n:15][cH:16][n:17][c:18]([O:20][CH:21]([CH2:22][CH:23]([CH3:24])[O:25][CH2:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[CH3:26])[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 58016930HCID 58016930, compound

Product 1

HCID 58016786HCID 58016786, compound

Sources & evidence

ORD record
ord-1bada649f8e34aeca75094c19cc17da8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…