Water → [2,2,2-Trifluoro-1-(4-phenylmethoxyphenyl)ethyl] hexanoate

HRID 91965

Reaction equation

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

Participants

Reactant 4

HCID 962Water

HCID 1049Pyridine

HCID 67340Hexanoyl chloride

HCID 212526644-(Benzyloxy)-alpha-(trifluoromethyl)benzyl Alcohol

Product 1

HCID 19738684[2,2,2-Trifluoro-1-(4-phenylmethoxyphenyl)ethyl] hexanoate

Sources & evidence

ORD record: ord-cc2da9bd7b8845bda7d16c1d7a695d26
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

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