Bromide ion → Mandipropamid

HRID 673754Notes

Reaction equation

HRID 673754 reaction equation
[Br-:45].[C:27](=[O:28])([O-:29])[O-:30].[CH2:33]([C:34]#[CH:35])[Cl:36].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[CH3:46][CH2:47][CH2:48][CH2:49][N+:50]([CH2:51][CH2:52][CH2:53][CH3:54])([CH2:55][CH2:56][CH2:57][CH3:58])[CH2:59][CH2:60][CH2:61][CH3:62].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([C:9](=[O:10])[NH:11][CH2:12][CH2:13][c:14]2[cH:15][c:16]([O:21][CH3:22])[c:17]([OH:20])[cH:18][cH:19]2)[O:23][CH2:24][C:25]#[CH:26])[cH:6][cH:7]1.[K+:31].[K+:32].[OH2:37]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([C:9](=[O:10])[NH:11][CH2:12][CH2:13][c:14]2[cH:15][c:16]([O:21][CH3:22])[c:17]([O:20][CH2:35][C:34]#[CH:33])[cH:18][cH:19]2)[O:23][CH2:24][C:25]#[CH:26])[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 122213-Chloro-1-propyneHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 235836252-(4-Chlorophenyl)-N-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-2-prop-2-ynoxyacetamide

Product 1

HCID 11292824Mandipropamid

Sources & evidence

ORD record
ord-662f019548974359af1683b66590762e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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