Acetic Acid → HCID 59256628, compound

HRID 2315390Notes

Reaction equation

HRID 2315390 reaction equation
[C:35]([OH:36])(=[O:37])[CH3:38].[CH3:27][CH2:28][OH:29].[Cl:5][c:6]1[c:7]([OH:26])[c:8]([N+:23]([O-:24])=[O:25])[c:9]([C:10](=[O:11])[NH:12][c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[c:20]([Cl:22])[cH:21]1.[Na+:34].[O-:30][C:31]([OH:32])=[O:33].[OH2:1].[Sn:2]([Cl:3])[Cl:4]>>[Cl:5][c:6]1[c:7]([OH:26])[c:8]([NH2:23])[c:9]([C:10](=[O:11])[NH:12][c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[c:20]([Cl:22])[cH:21]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 24479Stannous ChlorideHCID 59256555HCID 59256555, compound

Product 1

HCID 59256628HCID 59256628, compound

Sources & evidence

ORD record
ord-8dc86c5888ac4f7082b34ec319ef8e37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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