Chloride → Tert-butyl 6-chloro-5-hydroxy-3-oxohexanoate

HRID 669368

Reaction equation

HRID 669368 reaction equation
[C:6]([CH3:7])(=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13].[CH2:14]([O:16][C:17](=[O:15])[CH2:18][CH:19]([CH2:20][Cl:21])[OH:22])[CH3:23].[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37].[CH:24]([N-:25][CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[Cl-:3].[Cl-:5].[H-:1].[Li+:31].[Mg+2:4].[Na+:2].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1>>[C:6]([CH2:7][C:17](=[O:16])[CH2:18][CH:19]([CH2:20][Cl:21])[OH:22])(=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13]

Participants

11

Reactant 10

HCID 312Chloride2×HCID 888Magnesium CationHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8058HexaneHCID 10908tert-Butyl acetateHCID 28486Lithium ionHCID 166653HydrideHCID 4377704Butanoic acid, 4-chloro-3-hydroxy-, ethyl esterHCID 5062348Diisopropylamide

Product 1

HCID 4372076Tert-butyl 6-chloro-5-hydroxy-3-oxohexanoate

Sources & evidence

ORD record
ord-c48243036d3748e0a666f6f454e1559a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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