Acetic Acid → HCID 15538684, compound

HRID 686488Notes

Reaction equation

HRID 686488 reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:12]([N+:27]([O-:28])=[O:29])[c:13]1-[n:14]1[c:15](=[O:26])[n:16]([CH3:25])[c:17]([C:21]([F:22])([F:23])[F:24])[cH:18][c:19]1=[O:20])[N:6]([CH3:11])[C:7](=[O:10])[CH2:8][O:9]2.[Fe:34]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([c:12]([NH2:27])[c:13]1-[n:14]1[c:15](=[O:26])[n:16]([CH3:25])[c:17]([C:21]([F:22])([F:23])[F:24])[cH:18][c:19]1=[O:20])[N:6]([CH3:11])[C:7](=[O:10])[CH2:8][O:9]2

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 23925IronHCID 15538683HCID 15538683, compound

Product 1

HCID 15538684HCID 15538684, compound

Sources & evidence

ORD record
ord-479623edb3be453e99ae3689be19606c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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