1,4-Dimethyl-1H-1,2,3-triazole → HCID 178425080, compound

HRID 2018162Notes

Reaction equation

HRID 2018162 reaction equation
[CH3:1][c:2]1[n:29][c:20]([O:21][CH2:22][c:23]2[cH:28][cH:27][cH:26][cH:25][cH:24]2)[c:6]([CH2:7][N:8]3[C:18](=[O:19])[c:17]([c:11]4[CH2:10][CH2:9]3)[c:15]([Cl:16])[c:14](OS(C(F)(F)F)(=O)=O)[cH:13][cH:12]4)[c:4]([CH3:5])[cH:3]1.[CH3:30][c:31]1[n:36][n:35][n:33]([CH3:34])[cH:32]1>>[CH3:1][c:2]1[n:29][c:20]([O:21][CH2:22][c:23]2[cH:28][cH:27][cH:26][cH:25][cH:24]2)[c:6]([CH2:7][N:8]3[C:18](=[O:19])[c:17]([c:11]4[CH2:10][CH2:9]3)[c:15]([Cl:16])[c:14]([c:32]5[n:33]([CH3:34])[n:35][n:36][c:31]5[CH3:30])[cH:13][cH:12]4)[c:4]([CH3:5])[cH:3]1

Participants

8

Reactant 2

HCID 152571421,4-Dimethyl-1H-1,2,3-triazoleHCID 178425082HCID 178425082, compound

Product 1

HCID 178425080HCID 178425080, compound

Reagents, catalysts & solvents 5

HCID 583616Cesium pivalateReagentHCID 167845palladium(II) acetateCatalystHCID 178454858HCID 178454858, compoundCatalystHCID 8028TetrahydrofuranSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
120 °C

Sources & evidence

ORD record
ord-2e58aced1eea44eea9dd443cfb3ad03c
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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