Acetic Acid → HCID 74020148, compound

HRID 1237327Notes

Reaction equation

HRID 1237327 reaction equation
[CH3:32][C:33](=[O:34])[OH:35].[Cl-:31].[Cl:1][c:2]1[c:3]([OH:24])[c:4]([CH:11]([CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[OH:23])[c:5]([OH:10])[c:6]([CH:7]=[O:8])[cH:9]1.[Na+:30].[P:25](=[O:26])([OH:27])([OH:28])[OH:29]>>[Cl:1][c:2]1[c:3]([OH:24])[c:4]([CH:11]=[CH:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:5]([OH:10])[c:6]([CH:7]=[O:8])[cH:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 312ChlorideHCID 923Sodium ionHCID 1004Phosphoric AcidHCID 23134875HCID 23134875, compound

Product 1

HCID 74020148HCID 74020148, compound

Sources & evidence

ORD record
ord-16b8a43ac0f94987826c4654e6d857f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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