Acetic Acid → HCID 67103616, compound

HRID 672539Notes

Reaction equation

HRID 672539 reaction equation
[CH3:31][C:32](=[O:33])[OH:34].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[Cl:1][c:2]1[c:3]([O:29][CH3:30])[cH:4][c:5]([N:8]2[CH2:9][CH2:10][N:11]([C:14]([CH2:15][n:16]3[n:17][cH:18][c:19]4[c:20]3[n:21][cH:22][c:23]([N+:25]([O-:26])=[O:27])[cH:24]4)=[O:28])[CH2:12][CH2:13]2)[cH:6][cH:7]1.[Fe:41]>>[Cl:1][c:2]1[c:3]([O:29][CH3:30])[cH:4][c:5]([N:8]2[CH2:9][CH2:10][N:11]([C:14]([CH2:15][n:16]3[n:17][cH:18][c:19]4[c:20]3[n:21][cH:22][c:23]([NH2:25])[cH:24]4)=[O:28])[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 8857Ethyl AcetateHCID 23925IronHCID 67103617HCID 67103617, compound

Product 1

HCID 67103616HCID 67103616, compound

Sources & evidence

ORD record
ord-2da61ed0fe08436abb9da029e9465f91
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…