Chloride → 1,2,3,6,7,8-Hexahydro-5H-cyclopenta[b]naphthalen-5-one

HRID 149103

Reaction equation

HRID 149103 reaction equation
[Al+3:2].[CH2:52]([Cl:53])[Cl:54].[CH2:5]1[CH2:6][CH2:7][c:8]2[cH:9][cH:10][cH:11][cH:12][c:13]21.[CH3:47][CH2:48][OH:49].[CH3:50][OH:51].[Cl-:1].[Cl-:3].[Cl-:4].[Cl:29][Sn:30]([Cl:31])([Cl:32])[Cl:33].[Cl:38][CH2:39][Cl:40].[ClH:21].[N+:34]([CH3:35])([O-:36])=[O:37].[Na+:28].[O:14]=[C:15]1[CH2:16][CH2:17][C:18](=[O:20])[O:19]1.[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH-:27].[S:22](=[O:23])(=[O:24])([OH:25])[OH:26]>>[CH2:5]1[CH2:6][CH2:7][c:8]2[cH:9][c:10]3[c:11]([cH:12][c:13]21)[CH2:18][CH2:17][CH2:16][C:15]3=[O:14]

Participants

15

Reactant 14

HCID 312Chloride3×HCID 313Hydrochloric AcidHCID 702EthanolHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 1118Sulfuric AcidHCID 6344Dichloromethane2×HCID 6375NitromethaneHCID 7922Succinic anhydrideHCID 10326IndaneHCID 24287Tin tetrachlorideHCID 312751,4-DioxaneHCID 104727Aluminum Cation

Product 1

HCID 126461851,2,3,6,7,8-Hexahydro-5H-cyclopenta[b]naphthalen-5-one

Sources & evidence

ORD record
ord-0491160bdb44455f8136693e86134221
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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