Acetic Acid → HCID 22105528, compound

HRID 2150156Notes

Reaction equation

HRID 2150156 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH2:11][NH:12][c:13]2[c:14]([N+:24]([O-:25])=[O:26])[cH:15][c:16]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:22][cH:23]2)[cH:27][c:28]([Br:31])[cH:29][cH:30]1.[CH3:33][C:34](=[O:35])[OH:36].[Fe:37].[OH2:32]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH2:11][NH:12][c:13]2[c:14]([NH2:24])[cH:15][c:16]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:22][cH:23]2)[cH:27][c:28]([Br:31])[cH:29][cH:30]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 23925IronHCID 22105604HCID 22105604, compound

Product 1

HCID 22105528HCID 22105528, compound

Sources & evidence

ORD record
ord-8d49b0fd87484dcea429a5c3e91929f6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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