Acetic Acid → Ethyl 2-sulfo-1-cyclopentene-1-carboxylate

HRID 149434Notes

Reaction equation

HRID 149434 reaction equation
[B:5]([O:6][O-:7])([O-:8])[O-:9].[CH3:24][C:25](=[O:26])[OH:27].[Na+:10].[Na+:11].[Na+:12].[OH2:1].[OH2:2].[OH2:3].[OH2:4].[SH:13][C:14]1=[C:15]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:16][CH2:17][CH2:18]1>>[O:1]=[S:13](=[O:2])([OH:3])[C:14]1=[C:15]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:16][CH2:17][CH2:18]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ion3×HCID 962Water4×HCID 21718650Ethyl 2-sulfanylcyclopent-1-ene-1-carboxylateHCID 178526934HCID 178526934, compound

Product 1

HCID 18380058Ethyl 2-sulfo-1-cyclopentene-1-carboxylate

Sources & evidence

ORD record
ord-5831e85aecbf440392ec810dc348135f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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