Chloride → Ethyl 1-cyclopropyl-6,8-difluoro-7-vinyl-4-oxo-1,4-dihydro-quinoline-3-carboxylate

HRID 202980Notes

Reaction equation

HRID 202980 reaction equation
[C:47]([c:48]1[cH:49][c:50]([CH3:51])[cH:52][c:53]([C:54]([CH3:55])([CH3:56])[CH3:57])[c:58]1[OH:59])([CH3:60])([CH3:61])[CH3:62].[CH2:111]1[O:112][CH2:113][CH2:114][CH2:115]1.[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8]([CH:27]2[CH2:28][CH2:29]2)[c:9]2[c:10]([F:26])[c:11]([O:18][S:19]([C:20]([F:21])([F:22])[F:23])(=[O:24])=[O:25])[c:12]([F:17])[cH:13][c:14]2[c:15]1=[O:16].[CH:30](=[CH2:31])[Sn:32]([CH2:33][CH2:34][CH2:35][CH3:36])([CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH2:43][CH3:44].[Cl-:45].[F-:63].[Li+:46].[Pd:70]([Cl:71])[Cl:72].[c:73]1([P:74]([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)[cH:87][cH:88][cH:89][cH:90][cH:91]1.[c:92]1([P:93]([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[cH:106][cH:107][cH:108][cH:109][cH:110]1.[cH:116]1[cH:117][cH:118][n:119][cH:120][cH:121]1.[nH+:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8]([CH:27]2[CH2:28][CH2:29]2)[c:9]2[c:10]([F:26])[c:11]([CH:30]=[CH2:31])[c:12]([F:17])[cH:13][c:14]2[c:15]1=[O:16]

Participants

12

Reactant 11

HCID 312ChlorideHCID 1049PyridineHCID 8028TetrahydrofuranHCID 11776Triphenylphosphine2×HCID 24290Palladium ChlorideHCID 28179Fluoride IonHCID 28486Lithium ionHCID 314042,6-Di-tert-butyl-4-methylphenolHCID 81998TributylvinyltinHCID 4989215PyridiniumHCID 156368801-Cyclopropyl-7-trifluoromethylsulfonyloxy-6,8-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid ethyl ester

Product 1

HCID 15636884Ethyl 1-cyclopropyl-6,8-difluoro-7-vinyl-4-oxo-1,4-dihydro-quinoline-3-carboxylate

Sources & evidence

ORD record
ord-a9198c3f0047428f8b59d3813f810413
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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