Sodium ion → 5-Phenylpyridine-2-carbonitrile

HRID 1553985Notes

Reaction equation

HRID 1553985 reaction equation
[C:10](=[O:11])([O-:12])[O-:13].[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[N:9])[n:6][cH:7]1.[Na+:14].[Na+:15].[OH2:32].[OH2:33].[OH:16][B:17]([OH:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[cH:34]1[cH:35][cH:36][c:37]([P:38]([Pd:39]([P:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[P:78]([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[cH:109][cH:110]1>>[c:2]1(-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:3][cH:4][c:5]([C:8]#[N:9])[n:6][cH:7]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962Water2×HCID 1140TolueneHCID 19660Carbonate IonHCID 66827Phenylboronic AcidHCID 38339425-Chloro-2-cyanopyridineHCID 178420554HCID 178420554, compound

Product 1

HCID 9352765-Phenylpyridine-2-carbonitrile

Sources & evidence

ORD record
ord-af9216fd6b2b4512aa0c181f86a9296b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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