Water → 2-[4-(4-Chlorophenyl)phenyl]-5-ethyl-5-phenyl-1,3-dioxolan-4-one

HRID 2159003Notes

Reaction equation

HRID 2159003 reaction equation
[CH2:42]1[CH2:43][CH2:44][CH2:45][CH2:46][CH2:47]1.[CH3:48][CH2:49][O:50][C:51](=[O:52])[CH3:53].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([CH:12]=[O:13])[cH:14][cH:15]2)[cH:6][cH:7]1.[OH2:29].[OH2:41].[OH:16][C:17]([C:18](=[O:19])[OH:20])([CH2:21][CH3:22])[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[c:30]1([CH3:31])[cH:32][cH:33][c:34]([S:35]([OH:36])(=[O:37])=[O:38])[cH:39][cH:40]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([CH:12]3[O:13][C:17]([CH2:21][CH3:22])([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[C:18](=[O:19])[O:20]3)[cH:14][cH:15]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 962Water2×HCID 6101p-Toluenesulfonic acidHCID 8078CyclohexaneHCID 8857Ethyl AcetateHCID 2873222-Hydroxy-2-phenylbutanoic acidHCID 5925704'-Chloro[1,1'-biphenyl]-4-carbaldehyde

Product 1

HCID 127737622-[4-(4-Chlorophenyl)phenyl]-5-ethyl-5-phenyl-1,3-dioxolan-4-one

Sources & evidence

ORD record
ord-173f120af93b4a1681fee972e9bb0eea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…