Benzene → Chloride

HRID 1139916Notes

Reaction equation

HRID 1139916 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[CH:7]1[CH2:8][CH2:9][CH:10]([C:13](=[O:14])[OH:15])[CH2:11][CH2:12]1.[S:16]([Cl:17])([Cl:18])=[O:19].[cH:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[CH:7]1[CH2:8][CH2:9][CH:10]([C:13](=[O:14])[OH:15])[CH2:11][CH2:12]1.[Cl-:18]

Participants

5

Reactant 3

HCID 241BenzeneHCID 24386Thionyl ChlorideHCID 98831Cyclohexanecarboxylic acid, 4-hexyl-

Product 2

HCID 312ChlorideHCID 98831Cyclohexanecarboxylic acid, 4-hexyl-

Sources & evidence

ORD record
ord-78b451a72b644e23af7fd38c08444b64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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