Methanol → HCID 11292939, compound

HRID 89600Notes

Reaction equation

HRID 89600 reaction equation
[CH3:33][OH:34].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH:14]=[O:15])[cH:16][cH:17]2)[cH:6][cH:7]1.[NH2:18][c:19]1[cH:20][cH:21][c:22]2[c:23]([cH:31]1)[O:24][C:25]([CH3:29])([CH3:30])[O:26][C:27]2=[O:28].[OH2:32]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([CH:14]=[N:18][c:19]3[cH:20][cH:21][c:22]4[c:23]([cH:31]3)[O:24][C:25]([CH3:29])([CH3:30])[O:26][C:27]4=[O:28])[cH:16][cH:17]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 887MethanolHCID 962WaterHCID 1140TolueneHCID 112534834-[(4-Chlorophenyl)ethynyl]benzaldehydeHCID 231100727-Amino-2,2-dimethyl-4H-1,3-benzodioxine-4-one

Product 1

HCID 11292939HCID 11292939, compound

Sources & evidence

ORD record
ord-db3103bc3ce4464685440fa0c1cd0a1c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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