Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester

Base Information

Chemical Name:Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester
CAS No.:26315-61-7
Molecular Formula:C12H22O4
Molecular Weight:212.289
Hs Code.:2918300090
European Community (EC) Number:607-912-3
DSSTox Substance ID:DTXSID501314471
Nikkaji Number:J578.610J
Mol file:26315-61-7.mol

Synonyms:26315-61-7;Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester;(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 2-oxoacetate;(-)-menthyl glyoxylate;L-menthyl glyoxylate;L-menthylglyoxylate;SCHEMBL18920049;DTXSID501314471;(1R,4S)-p-Menthane-3beta-ol 2-oxoacetate;CS-0166037;(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl 2-oxoacetate;(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 2-oxoacetate? (Captopril Impurity pound(c)

Suppliers and Price of Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester

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

American Custom Chemicals Corporation
(1R)-(-)-MENTHYL GLYOXYLATE HYDRATE 95.00%
5G
$ 815.82

AHH
(L)-Methylglyoxylatehydrate 98%
0.5g
$ 730.00

Total 33 raw suppliers

Chemical Property of Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester

Chemical Property:

Vapor Pressure:0.00344mmHg at 25°C
Melting Point:76-78 °C
Refractive Index:1.458
Boiling Point:350.5 °C at 760 mmHg
Flash Point:165.8 °C
PSA：43.37000
Density:1,182 g/cm3
LogP:2.18930
Sensitive.:Air Sensitive
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:212.14124450
Heavy Atom Count:15
Complexity:235

Purity/Quality:

98%, ^*data from raw suppliers

(1R)-(-)-MENTHYL GLYOXYLATE HYDRATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.;
Hazard Codes:R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.;
Statements: 51/53
Safety Statements: 61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC(C(C1)OC(=O)C=O)C(C)C
Isomeric SMILES:C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C=O)C(C)C

Technology Process of Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester

There total 9 articles about Acetic acid, 2-oxo-, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester 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: 85.3%

: 21758-30-5
(1R,2S,5R)-(-)-menthyl dichloroacetate

: 26315-61-7
L-menthyl glyoxylate

Guidance literature:: With tetrabutylammomium bromide; In water; at 95 ℃; for 5h;

Reference yield: 50.0%

: 2216-51-5
(-)-menthol

: 298-12-4
Glyoxilic acid

: 26315-61-7
L-menthyl glyoxylate

Guidance literature:: With sulfuric acid; In di-isopropyl ether; for 72h; Reflux;
DOI:10.1021/acs.organomet.0c00530

Reference yield:

: 81529-62-6
(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 2-chloro-2-oxoacetate

: 26315-61-7
L-menthyl glyoxylate

: 111969-64-3
L-menthyl glyoxylate monohydrate

Guidance literature:: With tri-n-butyl-tin hydride; tetrakis(triphenylphosphine) palladium⁽⁰⁾; Title compound not separated from byproducts; 1.) PhH, r.t., 2 h, 2.) PhH, CH₂Cl₂, reflux, 1 h;
DOI:10.1055/s-1998-2198