Acetate → HCID 57642818, compound

HRID 1133842Notes

Reaction equation

HRID 1133842 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]3[n:16][c:17]([Cl:25])[n:18]([CH3:24])[c:19]3[n:20][c:21]([Cl:23])[n:22]2)[CH2:12][CH2:13]1.[C:31](=[O:32])([OH:33])[O-:34].[CH3:27][C:28]([O-:29])=[O:30].[CH3:37][S:38]([CH3:39])=[O:40].[ClH:36].[Na+:26].[Na+:35].[OH2:41]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[c:15]3[nH:16][c:17](=[O:29])[n:18]([CH3:24])[c:19]3[n:20][c:21]([Cl:23])[n:22]2)[CH2:12][CH2:13]1

Participants

8

Reactant 7

HCID 175AcetateHCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 962WaterHCID 57642862HCID 57642862, compound

Product 1

HCID 57642818HCID 57642818, compound

Sources & evidence

ORD record
ord-a4999126b1c24cb9a03d01e721c85681
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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