Hydrochloric Acid → HCID 90966800, compound

HRID 291597Notes

Reaction equation

[CH2:1]([CH3:2])[O:3][P:4](=[O:5])([O:6][CH2:7][CH3:8])[CH:9]=[CH:10][c:11]1[c:12]([O:22][CH2:23][c:24]2[cH:25][c:26]([O:50][CH3:51])[c:27]([O:28][CH2:29][c:30]3[n:31][c:32](-[c:36]4[cH:37][cH:38][c:39]([O:46][CH3:47])[c:40]([C:41](=[O:42])[O:43][CH3:44])[cH:45]4)[o:33][c:34]3[CH3:35])[cH:48][cH:49]2)[n:13][n:14](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:15]1.[CH3:61][CH2:62][OH:63].[ClH:59].[Na+:58].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH-:57].[OH2:60]>>[CH2:1]([CH3:2])[O:3][P:4](=[O:5])([O:6][CH2:7][CH3:8])[CH:9]=[CH:10][c:11]1[c:12]([O:22][CH2:23][c:24]2[cH:25][c:26]([O:50][CH3:51])[c:27]([O:28][CH2:29][c:30]3[n:31][c:32](-[c:36]4[cH:37][cH:38][c:39]([O:46][CH3:47])[c:40]([C:41](=[O:42])[OH:43])[cH:45]4)[o:33][c:34]3[CH3:35])[cH:48][cH:49]2)[n:13][n:14](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:15]1

Participants

Reactant 7

HCID 313Hydrochloric Acid

HCID 8028Tetrahydrofuran

HCID 90781112Methyl 5-[4-[[4-[[4-(2-diethoxyphosphorylethenyl)-1-phenylpyrazol-3-yl]oxymethyl]-2-methoxyphenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]-2-methoxybenzoate

Product 1

HCID 90966800HCID 90966800, compound

Sources & evidence

ORD record: ord-fb4cdf22bd114e309e1b6324521b5ea6
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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