Acetic Acid → Butanedioic acid, 2-hydroxy-3-methyl-, dimethyl ester

HRID 313525

Reaction equation

HRID 313525 reaction equation
[C:13]([CH:14]([OH:15])[CH2:16][C:17](=[O:18])[O:19][CH3:20])(=[O:21])[O:22][CH3:23].[CH2:8]([Li:9])[CH2:10][CH2:11][CH3:12].[CH3:24][I:25].[CH3:31][C:32](=[O:33])[OH:34].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[O:26]1[CH2:27][CH2:28][CH2:29][CH2:30]1.[OH2:35]>>[CH3:1][CH:16]([CH:14]([C:13](=[O:21])[O:22][CH3:23])[OH:15])[C:17](=[O:18])[O:19][CH3:20]

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 962WaterHCID 6328Methyl iodideHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 12674Dimethyl malateHCID 178418339Butyllithium

Product 1

HCID 546102Butanedioic acid, 2-hydroxy-3-methyl-, dimethyl ester

Sources & evidence

ORD record
ord-707d1f842c0d4ebbaa16eeefd188d621
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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