Chloride → Methyl 4-methoxy-2-(1-methylacetonyl)-acetoacetate

HRID 206942

Reaction equation

HRID 206942 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH2:24]([N+:25]([CH2:26][CH3:27])([CH2:28][CH3:29])[CH2:30][CH3:31])[c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH3:38][C:39]#[N:40].[CH3:7][O:8][CH2:9][C:10]([CH2:11][C:12](=[O:13])[O:14][CH3:15])=[O:16].[Cl-:23].[Cl:17][CH:18]([C:19]([CH3:20])=[O:21])[CH3:22].[K+:5].[K+:6]>>[CH3:7][O:8][CH2:9][C:10]([CH:11]([C:12](=[O:13])[O:14][CH3:15])[CH:18]([C:19]([CH3:20])=[O:21])[CH3:22])=[O:16]

Participants

8

Reactant 7

HCID 312ChlorideHCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 17208BenzyltriethylammoniumHCID 19660Carbonate IonHCID 200263-Chloro-2-butanoneHCID 123500Methyl 4-methoxyacetoacetate

Product 1

HCID 19871668Methyl 4-methoxy-2-(1-methylacetonyl)-acetoacetate

Sources & evidence

ORD record
ord-bd811d8641164bb0b338ae85d71936fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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