Nitromethane → Ethyl 4,4,4-trifluoro-3-(nitromethyl)butanoate

HRID 1139729

Reaction equation

HRID 1139729 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]=[CH:6][C:7]([F:8])([F:9])[F:10])=[O:11].[CH2:24]([CH2:25][C:26](=[O:27])[CH2:28][C:29]([O-:30])=[O:31])[CH3:32].[CH3:12][N:13]([CH3:14])[C:15]([N:16]([CH3:17])[CH3:18])=[NH:19].[N+:20](=[O:21])([O-:22])[CH3:23]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH:6]([C:7]([F:8])([F:9])[F:10])[CH2:23][N+:20](=[O:21])[O-:22])=[O:11]

Participants

5

Reactant 4

HCID 6375NitromethaneHCID 664601,1,3,3-TetramethylguanidineHCID 141226Ethyl 4,4,4-trifluorobut-2-enoateHCID 119662643-Oxohexanoate

Product 1

HCID 268363Ethyl 4,4,4-trifluoro-3-(nitromethyl)butanoate

Sources & evidence

ORD record
ord-57fbb7d35b5149fa85e5a826d558b5ad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

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