Acetate → HCID 22990155, compound

HRID 1146011Notes

Reaction equation

HRID 1146011 reaction equation
[CH2:19]([CH3:20])[O:21][CH2:22][CH2:23][CH2:24][c:25]1[cH:26][cH:27][c:28]([O:31][B:32]([OH:33])[OH:34])[cH:29][cH:30]1.[CH3:35][C:36](=[O:37])[O-:38].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[Cl:46][CH2:47][Cl:48].[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[CH:7]=[C:8]([C:14](=[O:15])[O:16][CH3:17])[CH2:9][CH2:10][S:11]2(=[O:12])=[O:13]>>[O:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:18]1)[CH:7]=[C:8]([C:14](=[O:15])[O:16][CH3:17])[CH2:9][CH2:10][S:11]2(=[O:12])=[O:13])[c:28]1[cH:27][cH:26][c:25]([CH2:24][CH2:23][CH2:22][O:21][CH2:19][CH3:20])[cH:30][cH:29]1

Participants

6

Reactant 5

HCID 175AcetateHCID 6344DichloromethaneHCID 8471TriethylamineHCID 22989977Methyl 7-hydroxy-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxylateHCID 22990125HCID 22990125, compound

Product 1

HCID 22990155HCID 22990155, compound

Sources & evidence

ORD record
ord-7060044050f34eed96095ddc5aad65b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…