Dichloromethane → 5-Cyclopentylsulfanyl-1-(4-methoxycarbonylphenyl)pyrazole-4-carboxylic acid

HRID 119976Notes

Reaction equation

HRID 119976 reaction equation
[CH:8]1([S:13][c:14]2[c:15]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[cH:16][n:17][n:18]2-[c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[O:27][CH3:28])[cH:23][cH:24]2)[CH2:9][CH2:10][CH2:11][CH2:12]1.[Cl:36][CH2:37][Cl:38].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[CH:8]1([S:13][c:14]2[c:15]([C:29](=[O:30])[OH:31])[cH:16][n:17][n:18]2-[c:19]2[cH:20][cH:21][c:22]([C:25](=[O:26])[O:27][CH3:28])[cH:23][cH:24]2)[CH2:9][CH2:10][CH2:11][CH2:12]1

Participants

4

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 59516116tert-butyl 5-(cyclopentylthio)-1-(4-(methoxycarbonyl)phenyl)-1H-pyrazole-4-carboxylate

Product 1

HCID 595161105-Cyclopentylsulfanyl-1-(4-methoxycarbonylphenyl)pyrazole-4-carboxylic acid

Sources & evidence

ORD record
ord-40ae3eed23244d799ab322511ef175ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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