Chloride → HCID 57845845, compound

HRID 2348812Notes

Reaction equation

HRID 2348812 reaction equation
[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl-:1].[Cl:19][c:20]1[c:21]([O:22][CH2:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[cH:30][cH:31][c:32]([NH2:34])[cH:33]1.[c:2]1(-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:3][cH:4][c:5]([C:8]#[C:9][C:10](=[O:11])[OH:12])[cH:6][cH:7]1>>[c:2]1(-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:3][cH:4][c:5]([C:8]#[C:9][C:10](=[O:12])[NH:34][c:32]2[cH:31][cH:30][c:21]([O:22][CH2:23][CH2:24][N:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[c:20]([Cl:19])[cH:33]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 312ChlorideHCID 1140TolueneHCID 8857Ethyl AcetateHCID 167916763-Chloro-4-(2-diethylaminoethoxy)phenylamineHCID 654541843-([1,1'-Biphenyl]-4-YL)propiolic acid

Product 1

HCID 57845845HCID 57845845, compound

Sources & evidence

ORD record
ord-e436b879ac734e05803ed3cf8ac429b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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