Hydrochloric Acid → Permethric acid

HRID 1568225Notes

Reaction equation

HRID 1568225 reaction equation
[CH2:17]([O:18][S:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)(=[O:26])=[O:27])[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[C:7]([CH3:13])([CH3:14])[CH:8]1[CH:9]=[C:10]([Cl:11])[Cl:12].[CH3:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46].[ClH:40].[Na+:16].[Na:39].[OH-:15].[OH2:47]>>[O:3]=[C:4]([OH:5])[CH:6]1[C:7]([CH3:13])([CH3:14])[CH:8]1[CH:9]=[C:10]([Cl:11])[Cl:12]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8058HexaneHCID 15900Dodecyl benzenesulfonateHCID 101094Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, ethyl esterHCID 5360545Sodium

Product 1

HCID 91658Permethric acid

Sources & evidence

ORD record
ord-9532f0b82808402f9dafa67aa671bb52
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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