Acetic Acid → HCID 10665811, compound

HRID 1132312Notes

Reaction equation

HRID 1132312 reaction equation
[BrH:33].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[CH3:41][C:42](=[O:43])[OH:44].[O:1]=[C:2]1[S:3][CH:4]([CH2:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([n:14][c:15]([CH2:17][c:18]4[cH:19][cH:20][c:21]([O:24][CH2:25][c:26]5[cH:27][cH:28][cH:29][cH:30][cH:31]5)[cH:22][cH:23]4)[o:16]3)[cH:32]2)[C:5](=[O:7])[NH:6]1.[OH2:40]>>[O:1]=[C:2]1[S:3][CH:4]([CH2:8][c:9]2[cH:10][cH:11][c:12]3[c:13]([n:14][c:15]([CH2:17][c:18]4[cH:19][cH:20][c:21]([OH:24])[cH:22][cH:23]4)[o:16]3)[cH:32]2)[C:5](=[O:7])[NH:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 962WaterHCID 8857Ethyl AcetateHCID 14674504HCID 14674504, compound

Product 1

HCID 10665811HCID 10665811, compound

Sources & evidence

ORD record
ord-3b4a607f75e2418098bc102170105009
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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