Aniline → HCID 46523747, compound

HRID 2316173Notes

Reaction equation

[CH3:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][n:10]1.[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[NH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[P-:30]([F:31])([F:32])([F:33])([F:34])([F:35])[F:36].[n:37]1([O:38][C:39]([N:40]([CH3:41])[CH3:42])=[N+:43]([CH3:44])[CH3:45])[c:46]2[n:47][cH:48][cH:49][cH:50][c:51]2[n:52][n:53]1>>[CH3:1][c:2]1[c:3]([C:4](=[O:6])[NH:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:7][c:8]([N+:11](=[O:12])[O-:13])[cH:9][n:10]1

Participants

Reactant 6

HCID 6115Aniline

HCID 6228Dimethylformamide

HCID 9886Hexafluorophosphate

HCID 81531Diisopropylethylamine

HCID 2872402-methyl-5-nitronicotinic acid

HCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 46523747HCID 46523747, compound

Sources & evidence

ORD record: ord-25bc3223fd1040fc882084553c3f5f41
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…