4-Aminobenzoic Acid → HCID 20120398, compound

HRID 698037Notes

Reaction equation

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

Participants

Reactant 6

HCID 9784-Aminobenzoic Acid

HCID 6228Dimethylformamide

HCID 9886Hexafluorophosphate

HCID 81531Diisopropylethylamine

HCID 104477N,N,2,2-Tetramethylpropane-1,3-diamine

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

Product 1

HCID 20120398HCID 20120398, compound

Sources & evidence

ORD record: ord-7150d1bb81df457b80b19339f36cc2ac
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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