Ethanol → Ethyl 2-(2,4-di-tert-butylphenoxy)caproate

HRID 166086Notes

Reaction equation

HRID 166086 reaction equation
[Br:19][CH:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH2:26][CH2:27][CH2:28][CH3:29].[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:15])[cH:7][cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1.[CH3:16][O-:17].[CH3:30][CH2:31][OH:32].[CH3:33][OH:34].[Na+:18]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([O:15][CH:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH2:26][CH2:27][CH2:28][CH3:29])[cH:7][cH:8][c:9]([C:11]([CH3:12])([CH3:13])[CH3:14])[cH:10]1

Participants

7

Reactant 6

HCID 702EthanolHCID 887MethanolHCID 923Sodium ionHCID 73112,4-Di-tert-butylphenolHCID 79072Ethyl 2-bromohexanoateHCID 3826051Methoxide

Product 1

HCID 11100155Ethyl 2-(2,4-di-tert-butylphenoxy)caproate

Sources & evidence

ORD record
ord-67a2f10451e846cda58d0de2a2ac0f16
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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