1-Butanol → HCID 14422859, compound

HRID 1565847Notes

Reaction equation

HRID 1565847 reaction equation
[CH2:36]([OH:37])[CH2:38][CH2:39][CH3:40].[Cl:13][CH2:14][CH2:15][CH:16]([CH2:17][O:18][c:19]1[cH:20][c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]1)[OH:29].[Na+:30].[Na+:31].[O-:32][C:33](=[O:34])[O-:35].[c:1]1([N:7]2[CH2:8][CH2:9][NH:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([N:7]2[CH2:8][CH2:9][N:10]([CH2:14][CH2:15][CH:16]([CH2:17][O:18][c:19]3[cH:20][c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]3)[OH:29])[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 2631-ButanolHCID 923Sodium ion2×HCID 70961-PhenylpiperazineHCID 19660Carbonate IonHCID 131203482-Butanol, 4-chloro-1-[3-(trifluoromethyl)phenoxy]-

Product 1

HCID 14422859HCID 14422859, compound

Sources & evidence

ORD record
ord-a7f7989f64ba4db2b1b905cb2aa0b8cc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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