Bromide ion → HCID 178459626, compound

HRID 1133026Notes

Reaction equation

HRID 1133026 reaction equation
[Br-:26].[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([CH:10]([C:11](=[O:12])[O:13][CH:14]([CH3:15])[CH3:16])[OH:17])[CH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[C:27](=[O:28])([O-:29])[OH:30].[CH3:32][C:33]1([CH3:42])[N:34]([O:35])[C:36]([CH3:37])([CH3:38])[CH2:39][CH2:40][CH2:41]1.[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[Cl:43][O-:44].[I-:47].[K+:46].[K+:53].[Na+:25].[Na+:31].[Na+:45].[OH2:61].[S:48]([O-:49])([OH:50])(=[O:51])=[O:52]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[NH:8][CH:9]([C:10]([C:11](=[O:12])[O:13][CH:14]([CH3:15])[CH3:16])=[O:17])[CH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1

Participants

12

Reactant 11

HCID 259Bromide ionHCID 769Bicarbonate IonHCID 813Potassium Cation2×HCID 923Sodium ion3×HCID 962WaterHCID 1140TolueneHCID 30165Iodide IonHCID 61739HypochloriteHCID 61778Sulfate, hydrogenHCID 5499762,2,6,6-Tetramethylpiperidin-1-olHCID 21302835beta-[[(1,1-Dimethylethoxy)carbonyl]amino]-alpha-hydroxybenzenebutanoic acid, 1-methylethyl ester

Product 1

HCID 178459626HCID 178459626, compound

Sources & evidence

ORD record
ord-577486912a944c579c3be6294eb4a5a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…