Acetic Acid → HCID 20373884, compound

HRID 1118474Notes

Reaction equation

HRID 1118474 reaction equation
[CH3:27][C:28](=[O:29])[OH:30].[O:1]=[C:2]1[CH:3]([CH:18]([CH3:19])[CH3:20])[CH2:4][c:5]2[cH:6][c:7]([O:13][CH2:14][C:15](=[O:16])[OH:17])[c:8]([Cl:12])[c:9]([Cl:11])[c:10]21.[OH2:26].[S:21]([Cl:22])(=[O:23])([Cl:24])=[O:25]>>[O:1]=[C:2]1[C:3]([CH:18]([CH3:19])[CH3:20])([Cl:24])[CH2:4][c:5]2[cH:6][c:7]([O:13][CH2:14][C:15](=[O:16])[OH:17])[c:8]([Cl:12])[c:9]([Cl:11])[c:10]21

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 24648Sulfuryl chlorideHCID 40499{[6,7-Dichloro-1-oxo-2-(propan-2-yl)-2,3-dihydro-1H-inden-5-yl]oxy}acetic acid

Product 1

HCID 20373884HCID 20373884, compound

Sources & evidence

ORD record
ord-207cdcccec3c4bf1bee4d4717cb84751
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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