Acetic Acid → HCID 178458305, compound

HRID 169672Notes

Reaction equation

HRID 169672 reaction equation
[CH3:21][C:22](=[O:23])[OH:24].[OH:1][c:2]1[cH:3][c:4]([C:18](=[O:19])[NH2:20])[n:5][c:6](-[c:8]2[c:9]([O:14][CH2:15][CH2:16][CH3:17])[cH:10][cH:11][cH:12][cH:13]2)[n:7]1.[P:25]([Cl:26])([Cl:27])([Cl:28])=[O:29]>>[OH:1][c:2]1[cH:3][c:4]([C:18]#[N:20])[n:5][c:6](-[c:8]2[c:9]([O:14][CH2:15][CH2:16][CH3:17])[cH:10][cH:11][cH:12][cH:13]2)[n:7]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 24813Phosphorus oxychlorideHCID 178458306HCID 178458306, compound

Product 1

HCID 178458305HCID 178458305, compound

Sources & evidence

ORD record
ord-8bdd10ffbf87453c9ffe8b34ffba6be0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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