Benzene → HCID 20368183, compound

HRID 120997Notes

Reaction equation

HRID 120997 reaction equation
[CH3:37][N:38]([CH3:39])[CH:40]=[O:41].[Cl:1][P:2]([Cl:3])[Cl:4].[F:9][P:10]([F:11])[F:12].[NH2:17][c:18]1[c:19]([C:35]#[N:36])[c:20](-[c:26]2[n:27]([CH3:34])[c:28]([N+:31](=[O:32])[O-:33])[cH:29][n:30]2)[n:21][n:22]1[CH2:23][CH2:24][OH:25].[P:5]([Br:6])([Br:7])[Br:8].[S:13]([Cl:14])([Cl:15])=[O:16].[cH:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[Cl:15][CH2:24][CH2:23][n:22]1[c:18]([NH2:17])[c:19]([C:35]#[N:36])[c:20](-[c:26]2[n:27]([CH3:34])[c:28]([N+:31](=[O:32])[O-:33])[cH:29][n:30]2)[n:21]1

Participants

8

Reactant 7

HCID 241BenzeneHCID 6228DimethylformamideHCID 24386Thionyl ChlorideHCID 24387Phosphorus trichlorideHCID 24614Phosphorus tribromideHCID 62665Phosphorus trifluorideHCID 20368169HCID 20368169, compound

Product 1

HCID 20368183HCID 20368183, compound

Sources & evidence

ORD record
ord-8bee479b1507453e9d769064775afdb6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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