Chloride → [4,5-diacetyloxy-6-(3-cyanophenoxy)thian-3-yl] acetate

HRID 193598Notes

Reaction equation

HRID 193598 reaction equation
[Ag+:40].[C:10]([CH3:11])(=[O:12])[O:13][CH:14]1[CH:15]([Br:28])[S:16][CH2:17][CH:18]([O:24][C:25]([CH3:26])=[O:27])[CH:19]1[O:20][C:21]([CH3:22])=[O:23].[CH2:29]([Cl:30])[Cl:31].[Cl-:41].[Cl-:43].[OH:1][c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][cH:8][cH:9]1.[Zn+2:42].[nH:32]1[cH:33][cH:34][n:35][c:36]1[C:37]([O-:38])=[O:39]>>[O:1]([c:2]1[cH:3][c:4]([C:5]#[N:6])[cH:7][cH:8][cH:9]1)[CH:15]1[CH:14]([O:13][C:10]([CH3:11])=[O:12])[CH:19]([O:20][C:21]([CH3:22])=[O:23])[CH:18]([O:24][C:25]([CH3:26])=[O:27])[CH2:17][S:16]1

Participants

8

Reactant 7

HCID 312Chloride2×HCID 6344DichloromethaneHCID 133943-CyanophenolHCID 32051Zinc(2+)HCID 104755Silver cationHCID 69736001H-imidazole-2-carboxylateHCID 14374025(3S,4S,5R,6S)-4,5-bis(acetyloxy)-6-bromothian-3-yl acetate

Product 1

HCID 178475693[4,5-diacetyloxy-6-(3-cyanophenoxy)thian-3-yl] acetate

Sources & evidence

ORD record
ord-30f29c6c15394554b05901259bdf25f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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