Dabco → HCID 72310125, compound

HRID 1231588Notes

Reaction equation

HRID 1231588 reaction equation
[CH2:44]1[N:45]2[CH2:46][CH2:47][N:48]([CH2:49][CH2:50]2)[CH2:51]1.[Cl:1][c:2]1[c:3]([CH:9]([C:10]([C:11]([F:12])([F:13])[F:14])([OH:15])[c:16]2[cH:17][cH:18][c:19]3[c:20]([cH:27]2)[N:21]([CH3:26])[C:22](=[O:25])[CH2:23][O:24]3)[CH3:28])[cH:4][cH:5][c:6]([OH:8])[cH:7]1.[Cl:29][c:30]1[n:31][cH:32][c:33]([C:40](=[O:41])[O:42][CH3:43])[c:34]([C:36]([F:37])([F:38])[F:39])[n:35]1>>[Cl:1][c:2]1[c:3]([CH:9]([C:10]([C:11]([F:12])([F:13])[F:14])([OH:15])[c:16]2[cH:17][cH:18][c:19]3[c:20]([cH:27]2)[N:21]([CH3:26])[C:22](=[O:25])[CH2:23][O:24]3)[CH3:28])[cH:4][cH:5][c:6]([O:8][c:30]2[n:31][cH:32][c:33]([C:40](=[O:41])[O:42][CH3:43])[c:34]([C:36]([F:37])([F:38])[F:39])[n:35]2)[cH:7]1

Participants

4

Reactant 3

HCID 9237DabcoHCID 3696469Methyl 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylateHCID 666972396-[(2-chloro-4-hydroxy-phenyl)-1-hydroxy-1-trifluoromethyl-propyl]-4-methyl-4H-benzo[1,4]oxazin-3-one

Product 1

HCID 72310125HCID 72310125, compound

Sources & evidence

ORD record
ord-cb07dad37c3043f5ab90cc295517081c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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