Methyl (S)-(+)-3-hydroxybutyrate

Base Information

Chemical Name:Methyl (S)-(+)-3-hydroxybutyrate
CAS No.:53562-86-0
Molecular Formula:C5H10O3
Molecular Weight:118.133
Hs Code.:29181990
European Community (EC) Number:258-628-8
UNII:G10281A5AH
Nikkaji Number:J57.250K
Mol file:53562-86-0.mol

Synonyms:(+)-(3S)-3-Hydroxybutanoic acid methylester;(3S)-3-Hydroxybutanoic acid methyl ester;(S)-3-Hydroxybutanoic acidmethyl ester;(S)-Methyl3-hydroxybutanoate;Methyl (+)-3-hydroxybutanoate;Methyl (S)-3-hydroxybutyrate;

Suppliers and Price of Methyl (S)-(+)-3-hydroxybutyrate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Methyl (S)-(+)-3-hydroxybutyrate
1g
$ 75.00

TRC
Methyl (S)-(+)-3-hydroxybutyrate
250mg
$ 55.00

TCI Chemical
Methyl (S)-(+)-3-Hydroxybutyrate >98.0%(GC)
5mL
$ 84.00

TCI Chemical
Methyl (S)-(+)-3-Hydroxybutyrate >98.0%(GC)
25mL
$ 292.00

SynQuest Laboratories
Methyl (S)-(+)-3-hydroxybutyrate
25 g
$ 448.00

SynQuest Laboratories
Methyl (S)-(+)-3-hydroxybutyrate
5 g
$ 152.00

Sigma-Aldrich
(+)-Methyl (S)-3-hydroxybutyrate puriss.,≥99.0%(sumofenantiomers,GC)
1 mL
$ 125.00

Sigma-Aldrich
Methyl (S)-(+)-3-hydroxybutyrate 99%
1g
$ 85.70

Matrix Scientific
(S)-Methyl-3-hydroxybutyrate 99%
10g
$ 340.00

Matrix Scientific
(S)-Methyl-3-hydroxybutyrate 99%
1g
$ 52.00

Total 105 raw suppliers

Chemical Property of Methyl (S)-(+)-3-hydroxybutyrate

Chemical Property:

Appearance/Colour:clear colorless liquid
Vapor Pressure:0.768mmHg at 25°C
Refractive Index:n20/D 1.422
Boiling Point:161.9 °C at 760 mmHg
PKA:13.95±0.20(Predicted)
Flash Point:71.7 °C
PSA：46.53000
Density:1.05 g/cm³
LogP:-0.06970
Storage Temp.:0-6°C
Water Solubility.:Miscible with alcohol. Immiscible with water.
XLogP3:-0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:118.062994177
Heavy Atom Count:8
Complexity:79.7

Purity/Quality:

99% ^*data from raw suppliers

Methyl (S)-(+)-3-hydroxybutyrate ^*data from reagent suppliers

Safty Information:

Pictogram(s): 38-41:;
Hazard Codes:38-41:;
Statements: 38-41
Safety Statements: 23-24/25

MSDS Files:

Useful:

Canonical SMILES:CC(CC(=O)OC)O
Isomeric SMILES:C[C@@H](CC(=O)OC)O
Uses Methyl (S)-(+)-3-hydroxybutyrate serves as an optically active starting material used in organic synthesis. It is also used in the preparation of (-)-methyl elenolate. Methyl (S)-(+)-3-hydroxybutyrate may be used as an intermediate in the synthesis of (-)-methyl elenolate.

Technology Process of Methyl (S)-(+)-3-hydroxybutyrate

There total 40 articles about Methyl (S)-(+)-3-hydroxybutyrate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

: 105-45-3
acetoacetic acid methyl ester

: 53562-86-0
(S)-3-hydroxybutyric acid methyl ester

Guidance literature:: With cat; hydrogen; In methanol; dichloromethane; at 25 ℃; for 48h; under 77572.2 Torr;
DOI:10.1016/S0957-4166(00)86109-1

Reference yield: 100.0%

: 105-45-3
acetoacetic acid methyl ester

: 53562-86-0
(S)-3-hydroxybutyric acid methyl ester

: 3976-69-0
Methyl (R)-3-hydroxybutyrate

Guidance literature:: With Ru₂Cl₄-(S)-(2,2'-bis(diphenylphosphino)-1,1'-binaphthyl)2*NEt₃; hydrogen; In methanol; at 35 ℃; for 48h; under 76000.1 Torr; Title compound not separated from byproducts;
DOI:10.1016/0022-328X(92)83466-U

Reference yield: 97.0%

: 105-45-3
acetoacetic acid methyl ester

: 53562-86-0
(S)-3-hydroxybutyric acid methyl ester

: 3976-69-0
Methyl (R)-3-hydroxybutyrate

: 29267-46-7
3,3-bismethoxybutyric acid methyl ester

Guidance literature:: With hydrogen; {RuI((R)-2,2'-bis(diphenylphospino)-1,1'-binaphthyl)(p-cymene)}I; In methanol; at 30 ℃; for 35h; under 76000 Torr; Product distribution; other: catalysts, solvents, time, pressure, temperatures;
DOI:10.1021/jo00090a026