Water → 3-Cyclopentyl-2-(3-methylsulfanylphenyl)propanoic acid

HRID 2139036Notes

Reaction equation

HRID 2139036 reaction equation
[CH2:35]([Cl:36])[Cl:37].[CH2:38]1[O:39][CH2:40][CH2:41][O:42][CH2:43]1.[CH:1]1([CH2:6][CH:7]([C:8](=[O:9])[N:10]([CH:11]([CH3:12])[CH:13]([OH:14])[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH3:21])[c:22]2[cH:23][c:24]([S:28][CH3:29])[cH:25][cH:26][cH:27]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[OH2:44].[S:30]([OH:31])(=[O:32])(=[O:33])[OH:34]>>[CH:1]1([CH2:6][CH:7]([C:8]([OH:9])=[O:31])[c:22]2[cH:23][c:24]([S:28][CH3:29])[cH:25][cH:26][cH:27]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

6

Reactant 5

HCID 962WaterHCID 1118Sulfuric AcidHCID 6344DichloromethaneHCID 312751,4-DioxaneHCID 178503164HCID 178503164, compound

Product 1

HCID 462235703-Cyclopentyl-2-(3-methylsulfanylphenyl)propanoic acid

Sources & evidence

ORD record
ord-a2c27412ad1349809a3c9530da0a5efb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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