Benzene → Hydrochloric Acid

HRID 2330166Notes

Reaction equation

HRID 2330166 reaction equation
[c:9]1([CH2:15][CH2:16][CH2:17][N:18]2[CH:19]([CH3:25])[CH2:20][NH:21][CH:22]([CH3:24])[CH2:23]2)[cH:10][cH:11][cH:12][cH:13][cH:14]1.[cH:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[o:1]1[c:2]([C:6](=[O:7])[Cl:8])[cH:3][cH:4][cH:5]1>>[ClH:8].[o:1]1[c:2]([C:6](=[O:7])[N:21]2[CH2:20][CH:19]([CH3:25])[N:18]([CH2:17][CH2:16][CH2:15][c:9]3[cH:10][cH:11][cH:12][cH:13][cH:14]3)[CH2:23][CH:22]2[CH3:24])[cH:3][cH:4][cH:5]1

Participants

5

Reactant 3

HCID 241BenzeneHCID 682422-Furancarbonyl chlorideHCID 214191082,5-Dimethyl-1-(3-phenylpropyl)piperazine

Product 2

HCID 313Hydrochloric AcidHCID 21530264[2,5-Dimethyl-4-(3-phenylpropyl)piperazin-1-yl]-(furan-2-yl)methanone

Sources & evidence

ORD record
ord-edfe5a2c24674b128c563a78134e084a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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