Acetic Acid → HCID 57565595, compound

HRID 320780Notes

Reaction equation

HRID 320780 reaction equation
[CH3:39][C:40](=[O:41])[OH:42].[Cl:1][c:2]1[c:3]([CH2:4][n:5]2[c:6]([N:25]3[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]3)[n:7][c:8]3[n:9]([CH:22]([CH3:23])[CH3:24])[c:10](=[O:21])[n:11]([CH2:15][CH2:16][C:17](=[O:18])[O:19][CH3:20])[c:12](=[O:14])[c:13]23)[c:31]([F:35])[cH:32][cH:33][cH:34]1.[Li+:38].[OH-:37].[OH2:36]>>[Cl:1][c:2]1[c:3]([CH2:4][n:5]2[c:6]([N:25]3[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]3)[n:7][c:8]3[n:9]([CH:22]([CH3:23])[CH3:24])[c:10](=[O:21])[n:11]([CH2:15][CH2:16][C:17](=[O:18])[OH:19])[c:12](=[O:14])[c:13]23)[c:31]([F:35])[cH:32][cH:33][cH:34]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 961HydroxideHCID 962WaterHCID 28486Lithium ionHCID 57565575HCID 57565575, compound

Product 1

HCID 57565595HCID 57565595, compound

Sources & evidence

ORD record
ord-6edc838806964276992aef556f39ef6e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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