Hydrochloric Acid → HCID 178456397, compound

HRID 184553Notes

Reaction equation

HRID 184553 reaction equation
[C:35]([O:36][CH2:37][CH3:38])(=[O:39])[Cl:40].[CH3:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[CH3:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47].[Cl:3][c:4]1[cH:5][cH:6][c:7]([CH:10]2[N:11]([CH2:23][CH:24]=[CH2:25])[CH2:12][CH2:13][N:14]([CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[CH2:15]2)[cH:8][cH:9]1.[ClH:1].[ClH:2].[Na+:34].[OH-:33].[OH2:41]>>[Cl:3][c:4]1[cH:5][cH:6][c:7]([CH:10]2[N:11]([CH2:23][CH:24]=[CH2:25])[CH2:12][CH2:13][N:14]([C:35]([O:36][CH2:37][CH3:38])=[O:39])[CH2:15]2)[cH:8][cH:9]1

Participants

9

Reactant 8

HCID 313Hydrochloric Acid2×HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 8058HexaneHCID 10928Ethyl chloroformateHCID 68577184HCID 68577184, compound

Product 1

HCID 178456397HCID 178456397, compound

Sources & evidence

ORD record
ord-858c6599ed1f4045af1d9cf22b4dc098
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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