Triethylamine → Diethyl (4-fluorophenyl)phosphonate

HRID 2316088Notes

Reaction equation

HRID 2316088 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([F:8])[cH:6][cH:7]1.[CH3:101][CH2:102][O:103][C:104](=[O:105])[CH3:106].[CH3:17][CH2:18][N:19]([CH2:20][CH3:21])[CH2:22][CH3:23].[P:9]([O:10][CH2:11][CH3:12])([O:13][CH2:14][CH3:15])[O-:16].[Pd:24].[c:25]1([P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:39][cH:40][cH:41][cH:42][cH:43]1.[c:44]1([P:45]([c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:58][cH:59][cH:60][cH:61][cH:62]1.[c:63]1([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[cH:77][cH:78][cH:79][cH:80][cH:81]1.[c:82]1([P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)[cH:96][cH:97][cH:98][cH:99][cH:100]1>>[c:2]1([P:9]([O:10][CH2:11][CH3:12])([O:13][CH2:14][CH3:15])=[O:16])[cH:3][cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 99931-Bromo-4-fluorobenzeneHCID 11776Triphenylphosphine4×HCID 23938PalladiumHCID 3780918Diethylphosphite

Product 1

HCID 13508438Diethyl (4-fluorophenyl)phosphonate

Sources & evidence

ORD record
ord-e2c559df2c4849d3bd4c01b2a60da5bd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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