Acetic Acid → (2-Bromophenylsulphonyl)nitromethane

HRID 203664Notes

Reaction equation

HRID 203664 reaction equation
[Br:7][c:8]1[c:9]([S:14](=[O:15])[O-:16])[cH:10][cH:11][cH:12][cH:13]1.[CH3:49][C:50](=[O:51])[OH:52].[Cl:53][CH2:54][Cl:55].[K:35].[N+:1](=[O:2])([O-:3])[CH3:4].[N:36]#[C:37][Fe-3:38]([C:39]#[N:40])([C:41]#[N:42])([C:43]#[N:44])([C:45]#[N:46])[C:47]#[N:48].[NH2:30][C:31](=[O:32])[NH2:33].[Na+:17].[Na+:28].[Na+:29].[Na+:6].[OH-:5].[OH2:34].[S:18]([O:19][O:20][S:21]([O-:22])(=[O:23])=[O:24])([O-:25])(=[O:26])=[O:27]>>[N+:1](=[O:2])([O-:3])[CH2:4][S:14]([c:9]1[c:8]([Br:7])[cH:13][cH:12][cH:11][cH:10]1)(=[O:15])=[O:16]

Participants

12

Reactant 11

HCID 176Acetic AcidHCID 923Sodium ion4×HCID 961HydroxideHCID 962WaterHCID 1176UreaHCID 6344DichloromethaneHCID 6375NitromethaneHCID 107879PeroxydisulfateHCID 5462222PotassiumHCID 184639142-BromobenzenesulfinateHCID 178511487HCID 178511487, compound

Product 1

HCID 19875052(2-Bromophenylsulphonyl)nitromethane

Sources & evidence

ORD record
ord-3f3dfb0d6ec84ab2834c31f85c6aca98
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…