Methyl 3-chloro-4-hydroxybenzoate → HCID 66619226, compound

HRID 2161100Notes

Reaction equation

HRID 2161100 reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12]2[CH:13]([CH2:14][OH:15])[CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:22][c:23]([F:27])[c:24]([F:26])[cH:25]3)[cH:6][cH:7]1.[Cl:28][c:29]1[cH:30][c:31]([C:32](=[O:33])[O:34][CH3:35])[cH:36][cH:37][c:38]1[OH:39].[N:40]([C:41]([O:42][C:43]([CH3:44])([CH3:45])[CH3:46])=[O:47])=[N:48][C:49]([O:50][C:51]([CH3:52])([CH3:53])[CH3:54])=[O:55]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12]2[CH:13]([CH2:14][O:15][c:38]2[c:29]([Cl:28])[cH:30][c:31]([C:32](=[O:33])[O:34][CH3:35])[cH:36][cH:37]2)[CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:22][c:23]([F:27])[c:24]([F:26])[cH:25]3)[cH:6][cH:7]1

Participants

4

Reactant 3

HCID 77580Methyl 3-chloro-4-hydroxybenzoateHCID 97268Di-tert-butyl azodicarboxylateHCID 666193102-[2-(4-Chloro-phenyl)-5,6-difluoro-benzoimidazol-1-yl]-2-cyclohexyl-ethanol

Product 1

HCID 66619226HCID 66619226, compound

Sources & evidence

ORD record
ord-8ab2efce58e6462fa908a604748beca7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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