Dichloromethane → 4-(5-Isopropoxy-2-methyl-4-nitrophenyl)cyclohex-3-enone

HRID 1553184Notes

Reaction equation

HRID 1553184 reaction equation
[CH3:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30].[CH3:31][CH2:32][O:33][C:34]([CH3:35])=[O:36].[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([N+:22](=[O:23])[O-:24])[cH:7][c:8]([CH3:21])[c:9]([C:11]2=[CH:12][CH2:13][C:14]3([O:15][CH2:18][CH2:17][O:16]3)[CH2:19][CH2:20]2)[cH:10]1.[Cl:44][CH2:45][Cl:46].[F:37][C:38]([F:39])([F:40])[C:41]([OH:42])=[O:43]>>[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[c:6]([N+:22](=[O:23])[O-:24])[cH:7][c:8]([CH3:21])[c:9]([C:11]2=[CH:12][CH2:13][C:14](=[O:15])[CH2:19][CH2:20]2)[cH:10]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8058HexaneHCID 8857Ethyl AcetateHCID 597645528-(5-Isopropoxy-2-methyl-4-nitrophenyl)-1,4-dioxaspiro[4.5]dec-7-ene

Product 1

HCID 597643864-(5-Isopropoxy-2-methyl-4-nitrophenyl)cyclohex-3-enone

Sources & evidence

ORD record
ord-4dc4da2b45ec4ecb84b7f9b9a2b43b96
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…