HCID 16123656, compound → (3-Chloro-5-mercaptophenyl)acetic acid

HRID 136264Notes

Reaction equation

HRID 136264 reaction equation
[CH3:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([CH2:9][C:10]([OH:11])=[O:12])[cH:13][c:14]([C:15]([F:16])([F:17])[F:18])[cH:19]2)[n:20][cH:21][c:22]([S:8]([c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)(=[O:29])=[O:30])[cH:31]1.[Cl:32][c:33]1[cH:34][c:35]([CH2:40][C:41](=[O:42])[OH:43])[cH:36][c:37]([OH:39])[cH:38]1>>[SH:8][c:37]1[cH:36][c:35]([CH2:40][C:41](=[O:42])[OH:43])[cH:34][c:33]([Cl:32])[cH:38]1

Participants

3

Reactant 2

HCID 16123656HCID 16123656, compoundHCID 596446192-(3-Chloro-5-hydroxyphenyl)acetic acid

Product 1

HCID 66734548(3-Chloro-5-mercaptophenyl)acetic acid

Sources & evidence

ORD record
ord-0a652b4f74394e94a7766ad3c065598a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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