Chloride → Ethyl 3-Hydroxybutyrate

HRID 286334

Reaction equation

HRID 286334 reaction equation
[C:10]([O:11][C:12]([N:13]1[CH2:14][CH:15]([P:16]([CH:17]2[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]2)[CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]2)[CH2:29][CH:30]1[CH2:31][P:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)[c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)=[O:45])([CH3:46])([CH3:47])[CH3:48].[C:1]([CH2:2][C:3](=[O:4])[CH3:5])(=[O:6])[O:7][CH2:8][CH3:9].[CH3:49][OH:50].[CH:54]1=[CH:61][CH2:60][CH2:59][CH:58]=[CH:57][CH2:56][CH2:55]1.[Cl-:53].[Cl-:63].[Cl-:64].[H:51][H:52].[Rh+3:62]>>[C:1]([CH2:2][CH:3]([OH:4])[CH3:5])(=[O:6])[O:7][CH2:8][CH3:9]

Participants

8

Reactant 7

HCID 312Chloride3×HCID 887MethanolHCID 8135cis,cis-1,5-CyclooctadieneHCID 8868Ethyl AcetoacetateHCID 167511Rhodium(3+)HCID 4643313Tert-butyl 4-dicyclohexylphosphanyl-2-(diphenylphosphanylmethyl)pyrrolidine-1-carboxylateHCID 178418361HCID 178418361, compound

Product 1

HCID 62572Ethyl 3-Hydroxybutyrate

Sources & evidence

ORD record
ord-f556e6a4b66e46519ae249bc790c3142
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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