Chloride → HCID 11280634, compound

HRID 2311733Notes

Reaction equation

HRID 2311733 reaction equation
[CH2:32]([N+:33]([CH2:34][CH3:35])([CH2:36][CH3:37])[CH2:38][CH3:39])[c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:2][N:3]([CH2:4][CH2:5][Cl:6])[CH3:7].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Cl-:31].[ClH:1].[F:8][c:9]1[cH:10][c:11]2[c:12]([cH:27][cH:28]1)[S:13][c:14]1[c:15]([cH:23][cH:24][cH:25][cH:26]1)-[c:16]1[s:17][c:18]([CH2:21][OH:22])[n:19][c:20]1-2.[Na+:30].[OH-:29].[OH2:53]>>[CH3:2][N:3]([CH2:4][CH2:5][O:22][CH2:21][c:18]1[s:17][c:16]2[c:20]([n:19]1)-[c:11]1[cH:10][c:9]([F:8])[cH:28][cH:27][c:12]1[S:13][c:14]1[c:15]-2[cH:23][cH:24][cH:25][cH:26]1)[CH3:7]

Participants

10

Reactant 9

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 79012-Chloro-N,N-dimethylethylamineHCID 17208BenzyltriethylammoniumHCID 69369316HCID 69369316, compound

Product 1

HCID 11280634HCID 11280634, compound

Sources & evidence

ORD record
ord-a5d5d3c66bef41f0a5eda49f80081887
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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