Acetic Acid → 5-Methanesulfonyl-1H-indole-2-carboxylic acid

HRID 1561088

Reaction equation

HRID 1561088 reaction equation
[CH2:24]1[O:25][CH2:26][CH2:27][CH2:28]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[nH:6][c:7]2[cH:8][cH:9][c:10]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:11][c:12]2[cH:13]1.[CH3:20][C:21](=[O:22])[OH:23].[Li+:19].[OH-:18].[OH2:29]>>[O:2]=[C:3]([OH:4])[c:5]1[nH:6][c:7]2[cH:8][cH:9][c:10]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:11][c:12]2[cH:13]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 735868Methyl 5-(methylsulfonyl)-1H-indole-2-carboxylate

Product 1

HCID 223944465-Methanesulfonyl-1H-indole-2-carboxylic acid

Sources & evidence

ORD record
ord-b28830ac43b34bea8277cb3e8c496211
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Linked notes

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