Acetic Acid → Dimethyl-2-oxo-3-phenylpropyl phosphonate

HRID 172285

Reaction equation

HRID 172285 reaction equation
[CH2:12]([Li:13])[CH2:14][CH2:15][CH3:16].[CH3:1][P:2]([O:3][CH3:4])([O:5][CH3:6])=[O:7].[CH3:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38].[CH3:39][C:40](=[O:41])[OH:42].[O:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1.[PH:8](=[O:9])([O-:10])[O-:11].[c:17]1([CH2:23][C:24](=[O:25])[O:26][CH3:27])[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[CH2:1]([P:2]([O:3][CH3:4])([O:5][CH3:6])=[O:7])[C:24]([CH2:23][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)=[O:25]

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 406CID 406HCID 7559Methyl phenylacetateHCID 8028TetrahydrofuranHCID 8058HexaneHCID 12958Dimethyl methylphosphonateHCID 178418339Butyllithium

Product 1

HCID 12805884Dimethyl-2-oxo-3-phenylpropyl phosphonate

Sources & evidence

ORD record
ord-5c49476f796b49e6b05a6bd40a2f560a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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