Acetic Acid → HCID 178496989, compound

HRID 173831Notes

Reaction equation

HRID 173831 reaction equation
[CH3:27][C:28](=[O:29])[OH:30].[Cl:1][c:2]1[c:3]([NH:9][c:10]2[n:11][c:12]3[c:13]([nH:14]2)[c:15]([N+:24]([O-:25])=[O:26])[c:16]([OH:23])[c:17]([C:19](=[O:20])[O:21][CH3:22])[cH:18]3)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1.[Fe:37].[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[Cl:1][c:2]1[c:3]([NH:9][c:10]2[n:11][c:12]3[c:13]([nH:14]2)[c:15]([NH2:24])[c:16]([OH:23])[c:17]([C:19](=[O:20])[O:21][CH3:22])[cH:18]3)[c:4]([Cl:8])[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 241BenzeneHCID 23925IronHCID 178496990HCID 178496990, compound

Product 1

HCID 178496989HCID 178496989, compound

Sources & evidence

ORD record
ord-ed078e6f7a3c428a809e625472a71a23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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