Chloride → Methyl 5-phenyl-3,5-dihydroxypentanoate

HRID 166068Notes

Reaction equation

HRID 166068 reaction equation
[C:17]([BH3-:18])#[N:19].[CH3:23][OH:24].[CH3:25][CH:26]([CH3:27])[O-:28].[CH3:29][CH:30]([CH3:31])[O-:32].[CH3:33][CH:34]([CH3:35])[O-:36].[Cl-:37].[ClH:22].[Na+:20].[OH2:21].[Ti+4:38].[c:1]1([CH:7]([CH2:8][C:9]([CH2:10][C:11](=[O:12])[O:13][CH3:14])=[O:15])[OH:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH2:8][CH:9]([CH2:10][C:11](=[O:12])[O:13][CH3:14])[OH:15])[OH:16])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

10

Reactant 9

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 114942Titanium cation (4+)HCID 498716Cyano-borohydrideHCID 3260420Isopropanolate3×HCID 11020460Methyl 5-hydroxy-3-oxo-5-phenylpentanoate

Product 1

HCID 19003817Methyl 5-phenyl-3,5-dihydroxypentanoate

Sources & evidence

ORD record
ord-0c05e3ef11174d7894eed7e9a4910431
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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