Hydrochloric Acid → HCID 178498014, compound

HRID 87270Notes

Reaction equation

HRID 87270 reaction equation
[CH3:14][O:15][C:16]([c:17]1[cH:18][cH:19][c:20]([CH2:23][Br:24])[cH:21][cH:22]1)=[O:25].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:34][OH:35].[CH3:36][CH2:37][OH:38].[ClH:33].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[c:7]([nH:8][c:9]([SH:11])[n:10]2)[cH:12][cH:13]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[c:7]([nH:8][c:9]([S:11][CH2:23][c:20]3[cH:19][cH:18][c:17]([C:16]([O:15][CH3:14])=[O:25])[cH:22][cH:21]3)[n:10]2)[cH:12][cH:13]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 702EthanolHCID 887MethanolHCID 8471TriethylamineHCID 256687Methyl 4-(bromomethyl)benzoateHCID 178526489HCID 178526489, compound

Product 1

HCID 178498014HCID 178498014, compound

Sources & evidence

ORD record
ord-9c6136166d0a479f9db6d972e1e5d912
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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