Ammonium → HCID 91055253, compound

HRID 118783Notes

Reaction equation

HRID 118783 reaction equation
[Br-:1].[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][CH2:10][CH2:11][CH2:12][P+:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[CH3:32][Si:33]([N-:34][Si:35]([CH3:36])([CH3:37])[CH3:38])([CH3:39])[CH3:40].[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[Cl-:65].[NH2:42][c:43]1[c:44]([CH:63]=[O:64])[c:45](-[c:56]2[cH:57][cH:58][c:59]([F:62])[cH:60][cH:61]2)[c:46]([C:52](=[O:53])[O:54][CH3:55])[c:47]([CH:49]([CH3:50])[CH3:51])[n:48]1.[NH4+:66].[Na+:41].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][CH2:10][CH2:11][CH:12]=[CH:63][c:44]1[c:43]([NH2:42])[n:48][c:47]([CH:49]([CH3:50])[CH3:51])[c:46]([C:52](=[O:53])[O:54][CH3:55])[c:45]1-[c:56]1[cH:57][cH:58][c:59]([F:62])[cH:60][cH:61]1

Participants

10

Reactant 9

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 3280088Npc316347HCID 6379708HCID 6379708, compoundHCID 11438468HCID 11438468, compound

Product 1

HCID 91055253HCID 91055253, compound

Sources & evidence

ORD record
ord-4879006c7680444ea7c67f2ff6dc3515
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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