Chloride → 4-chloro-2,3-dihydro-1H-inden-1-one

HRID 291715

Reaction equation

HRID 291715 reaction equation
[Al+3:27].[C:1](=[O:2])([OH:3])[CH2:4][CH2:5][c:6]1[c:7]([Cl:12])[cH:8][cH:9][cH:10][cH:11]1.[CH3:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23].[Cl-:24].[Cl-:25].[Cl-:26].[OH2:28].[S:13]([Cl:14])([Cl:15])=[O:16]>>[C:1]1(=[O:3])[CH2:4][CH2:5][c:6]2[c:7]([Cl:12])[cH:8][cH:9][cH:10][c:11]21

Participants

7

Reactant 6

HCID 312Chloride3×HCID 962WaterHCID 8900HeptaneHCID 24386Thionyl ChlorideHCID 956763-(2-Chlorophenyl)propanoic acidHCID 104727Aluminum Cation

Product 1

HCID 113326814-chloro-2,3-dihydro-1H-inden-1-one

Sources & evidence

ORD record
ord-c468b5c0385446caa81f72c0cbf89afb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

Loading…