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Sodium Ion → 4,6-Diamino-2-phenyl-nicotinonitrile

HRID 288187
Notes
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Reaction equation

HRID 288187 reaction equation
[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[CH3:55][CH2:56][CH2:57][CH2:58][CH2:59][CH3:60].[NH2:1][c:2]1[cH:3][c:4]([NH2:11])[n:5][c:6]([Br:10])[c:7]1[C:8]#[N:9].[Na+:43].[Na+:44].[O-:45][C:46](=[O:47])[O-:48].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH2:61].[OH:12][B:13]([OH:14])[c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[c:21]1([CH3:22])[cH:23][cH:24][cH:25][cH:26][c:27]1[P:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][c:34]1[CH3:35])[c:36]1[cH:37][cH:38][cH:39][cH:40][c:41]1[CH3:42]>>[NH2:1][c:2]1[cH:3][c:4]([NH2:11])[n:5][c:6](-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[c:7]1[C:8]#[N:9]
ParticipantsSources & evidenceReaction notes

Participants

11

Reactant 10

HCID 923Sodium Ion2×HCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 19660Carbonate Ion
HCID 66827
Phenylboronic Acid
HCID 80271Tri-o-tolylphosphine
HCID 1706684,6-Diamino-2-bromo-3-pyridinecarbonitrile

Product 1

HCID 669206084,6-Diamino-2-phenyl-nicotinonitrile

Sources & evidence

ORD record
ord-bc86e244c2664b4f8914238b0e9e428d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes