(3R,4S)-Dimethyl 3,4-dimethylhexanedioate

Base Information

Chemical Name:(3R,4S)-Dimethyl 3,4-dimethylhexanedioate
CAS No.:6076-81-9
Molecular Formula:C₁₀H₁₈O₄
Molecular Weight:202.251
Hs Code.:2917190090
DSSTox Substance ID:DTXSID00548593
Nikkaji Number:J111.430A
Wikidata:Q82427342
Mol file:6076-81-9.mol

Synonyms:6076-81-9;(3R,4S)-Dimethyl 3,4-dimethylhexanedioate;dimethyl (3S,4R)-3,4-dimethylhexanedioate;Dimethyl (3R,4S)-3,4-dimethylhexanedioate;(3R,4S)-Dimethyl3,4-dimethylhexanedioate;DTXSID00548593

Suppliers and Price of (3R,4S)-Dimethyl 3,4-dimethylhexanedioate

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

Crysdot
(3R,4S)-Dimethyl3,4-dimethylhexanedioate 95+%
1g
$ 432.00

American Custom Chemicals Corporation
(3R,4S)-DIMETHYL-3,4-DIMETHYLHEXANEDIOATE 95.00%
5MG
$ 497.64

Total 5 raw suppliers

Chemical Property of (3R,4S)-Dimethyl 3,4-dimethylhexanedioate

Chemical Property:

Boiling Point:60-65 °C(Press: 0.2 Torr)
PSA：52.60000
Density:1.004±0.06 g/cm3(Predicted)
LogP:1.38480
Storage Temp.:2-8°C
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:202.12050905
Heavy Atom Count:14
Complexity:178

Purity/Quality:

98%Min ^*data from raw suppliers

(3R,4S)-Dimethyl3,4-dimethylhexanedioate 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of (3R,4S)-Dimethyl 3,4-dimethylhexanedioate

There total 4 articles about (3R,4S)-Dimethyl 3,4-dimethylhexanedioate 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: 91.0%

: 67-56-1
methanol

: 15474-81-4
(3R^*,4S^*)-3,4-dimethylhexanedioic acid

: 6076-81-9
dimethyl meso-3,4-dimethylhexane-1,6-dioate

Guidance literature:: With chloro-trimethyl-silane; for 24h; Ambient temperature;

Reference yield:

: 67-56-1
methanol

: 623-43-8
crotonic acid methyl ester

: 6076-81-9
dimethyl meso-3,4-dimethylhexane-1,6-dioate

: (3R,4R)-3,4-Dimethyl-hexanedioic acid dimethyl ester

Guidance literature:: crotonic acid methyl ester; With tetraethylammonium tosylate; In acetonitrile; at 20 ℃; Electrolysis;

With sodium hydroxide;

methanol; With hydrogenchloride; Further stages. Title compound not separated from byproducts.;
DOI:10.1021/jo026183k