Acetate → HCID 68500140, compound

HRID 1234673Notes

Reaction equation

HRID 1234673 reaction equation
[C:20]([O-:21])(=[O:22])[CH3:23].[CH3:25][C:26](=[O:27])[OH:28].[Cl:1][c:2]1[c:3]([CH3:19])[c:4]([CH3:18])[c:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([F:17])[c:13]([C:14]#[N:15])[cH:16]2)[n:6][n:7]1.[Na+:24]>>[c:2]1(=[O:22])[c:3]([CH3:19])[c:4]([CH3:18])[c:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([F:17])[c:13]([C:14]#[N:15])[cH:16]2)[n:6][nH:7]1

Participants

5

Reactant 4

HCID 175AcetateHCID 176Acetic AcidHCID 923Sodium ionHCID 86632300HCID 86632300, compound

Product 1

HCID 68500140HCID 68500140, compound

Sources & evidence

ORD record
ord-23263563b52748e98f9be73ece147157
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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