Chloride → ethyl(2RS,3RS)-3-hydroxy-3-(4-(phenyloxy)phenyl)-2-((3-((1,1,2,2-tetrafluoroethyl)oxy)phenyl)methyl)propionate

HRID 98098Notes

Reaction equation

HRID 98098 reaction equation
[BH4-:1].[CH3:40][CH2:41][O:42][CH2:43][CH3:44].[Cl-:45].[Cl-:47].[ClH:38].[Na+:2].[O:3]=[C:4]([CH:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[CH2:11][c:12]1[cH:13][c:14]([O:18][C:19]([CH:20]([F:21])[F:22])([F:23])[F:24])[cH:15][cH:16][cH:17]1)[c:25]1[cH:26][cH:27][c:28]([O:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:29][cH:30]1.[OH2:39].[Zn+2:46]>>[OH:3][CH:4]([CH:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[CH2:11][c:12]1[cH:13][c:14]([O:18][C:19]([CH:20]([F:21])[F:22])([F:23])[F:24])[cH:15][cH:16][cH:17]1)[c:25]1[cH:26][cH:27][c:28]([O:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[cH:29][cH:30]1

Participants

9

Reactant 8

HCID 312Chloride2×HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 962WaterHCID 3283Diethyl EtherHCID 28123BorohydrideHCID 32051Zinc(2+)HCID 22261740Ethyl 3-oxo-3-(4-phenyloxyphenyl)-2-((3-((1,1,2,2-tetrafluoroethyl)oxy)phenyl)methyl)propionate

Product 1

HCID 22261623ethyl(2RS,3RS)-3-hydroxy-3-(4-(phenyloxy)phenyl)-2-((3-((1,1,2,2-tetrafluoroethyl)oxy)phenyl)methyl)propionate

Sources & evidence

ORD record
ord-0e3c27df725e4722b19cbc4f796b2cf2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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