Phenol → HCID 6918291, compound

HRID 2339500Notes

Reaction equation

HRID 2339500 reaction equation
[Br:1][CH2:2][CH:3]1[C:4]([CH3:16])([CH3:17])[O:5][c:6]2[c:7]1[c:8]([CH3:15])[c:9]([OH:14])[c:10]([CH3:13])[c:11]2[CH3:12].[CH3:25][N:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[CH3:32][C:33]#[N:34].[OH:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1>>[CH2:2]([CH:3]1[C:4]([CH3:16])([CH3:17])[O:5][c:6]2[c:7]1[c:8]([CH3:15])[c:9]([OH:14])[c:10]([CH3:13])[c:11]2[CH3:12])[N:29]1[CH2:28][CH2:27][N:26]([CH3:25])[CH2:31][CH2:30]1

Participants

5

Reactant 4

HCID 996PhenolHCID 6342AcetonitrileHCID 531671-MethylpiperazineHCID 10334891HCID 10334891, compound

Product 1

HCID 6918291HCID 6918291, compound

Sources & evidence

ORD record
ord-ecd850095f514c298f08fa84e1d20772
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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