Acetic Acid → 4-(4-Methoxymethylcyclohexyl)-1-iodobenzene

HRID 2349925Notes

Reaction equation

HRID 2349925 reaction equation
[CH3:1][O:2][CH2:3][CH:4]1[CH2:5][CH2:6][CH:7]([c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[CH2:8][CH2:9]1.[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35].[CH3:42][C:43](=[O:44])[OH:45].[Cl:36][C:37]([Cl:38])([Cl:39])[Cl:40].[ClH:21].[I+2:16]([OH:17])([O-:18])[O-:19].[I:20].[Na+:27].[Na+:28].[OH2:41].[S:22]([O-:23])([O-:24])(=[O:25])=[S:26]>>[CH3:1][O:2][CH2:3][CH:4]1[CH2:5][CH2:6][CH:7]([c:10]2[cH:11][cH:12][c:13]([I:16])[cH:14][cH:15]2)[CH2:8][CH2:9]1

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 962WaterHCID 1084Thiosulfate ionHCID 5943Carbon TetrachlorideHCID 8900HeptaneHCID 24345Iodic acidHCID 24841Hydrogen iodideHCID 13742648trans-4-Methyloxymethyl-1-phenylcyclohexane

Product 1

HCID 137426494-(4-Methoxymethylcyclohexyl)-1-iodobenzene

Sources & evidence

ORD record
ord-1f2043e8012b41e9831c2b5bbe7e603d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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