Acetic Acid → HCID 21873648, compound

HRID 1574642Notes

Reaction equation

HRID 1574642 reaction equation
[CH2:18]([O:19][C:20](=[O:21])[c:22]1[cH:23][c:24]([N+:25]([O-:26])=[O:27])[c:28]([S:29][CH2:30][C:31]([O:32][CH2:33][CH3:34])=[O:35])[cH:36][c:37]1[F:38])[CH3:39].[CH2:1]([O:3][C:4](=[O:2])[c:6]1[c:7]([F:17])[cH:8][c:9]2[c:10]([cH:16]1)[NH:11][C:12](=[O:15])[CH2:13][S:14]2)[CH3:5].[CH3:40][C:41](=[O:42])[OH:43].[Fe:44]>>[O:3]=[CH:4][c:6]1[c:7]([F:17])[cH:8][c:9]2[c:10]([cH:16]1)[NH:11][C:12](=[O:15])[CH2:13][S:14]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 23925IronHCID 59560604Ethyl 4-[(2-ethoxy-2-oxoethyl)thio]-2-fluoro-5-nitrobenzoateHCID 59560644HCID 59560644, compound

Product 1

HCID 21873648HCID 21873648, compound

Sources & evidence

ORD record
ord-93f6595b930b44998a8be4b0842c72d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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