Dimethyl cyclopentane-1,3-dicarboxylate

Base Information

• Chemical Name: Dimethyl cyclopentane-1,3-dicarboxylate
• CAS No.: 2435-36-1
• Molecular Formula: C9H14O4
• Molecular Weight: 186.208
• Hs Code.: 2917209090
• DSSTox Substance ID: DTXSID20947201
• Nikkaji Number: J48.259E
• Mol file: 2435-36-1.mol

Synonyms:dimethyl cyclopentane-1,3-dicarboxylate;2435-36-1;Cyclopentane-1,3-dicarboxylic acid dimethyl ester;Dimethyl norcamphorate;1,3-Cyclopentanedicarboxylic acid, dimethyl ester;Norcamphoric acid, dimethyl ester;1,3-dimethyl cyclopentane-1,3-dicarboxylate;MFCD01735429;DIMETHYLCYCLOPENTANE-1,3-DICARBOXYLATE;1,3-dimethyl cyclopentane-1,3-dicarboxylate, cis;190137-08-7;Dimethyl 1,3-cyclopentanedicarboxylate;SCHEMBL2824374;DTXSID20947201;CS-D0066;1,3-Bis(methoxycarbonyl)cyclopentane;AKOS015851644;Dimethyl=1,3-cyclopentanedicarboxylate;AB86403;GS-3848;PB42363;Dimethyl 1,3-cyclopentanedicarboxylate #;AM803575;LS-57949;SY026168;FT-0695761;FT-0762290;EN300-139443;Dimethyl Cyclopentane-1,3-Dicarboxylate;Dimethyl 1,3-Cyclopentanedicarboxylate

Chemical Property of Dimethyl cyclopentane-1,3-dicarboxylate

Chemical Property:

• Vapor Pressure: 0.037mmHg at 25°C
• Refractive Index: 1.461
• Boiling Point: 240.829 °C at 760 mmHg
• Flash Point: 112.862 °C
• PSA: 52.60000
• Density: 1.136 g/cm³
• LogP: 0.74870
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), Ethyl Acetate (Slightly)
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 186.08920892
• Heavy Atom Count: 13
• Complexity: 190

Purity/Quality:

99% ^*data from raw suppliers

Dimethylcyclopentane-1,3-dicarboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CCC(C1)C(=O)OC
• Uses: Dimethyl cyclopentane-1,3-dicarboxylate (cas# 2435-36-1) is a useful research chemical, It can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.

Technology Process of Dimethyl cyclopentane-1,3-dicarboxylate

There total 8 articles about Dimethyl cyclopentane-1,3-dicarboxylate 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%

methanol (67-56-1) + cyclopentane-1,3-dicarboxylic acid (4056-78-4,826-02-8) → cyclopentane?1,3?dimethyl formate (2435-36-1)

Guidance literature:

With sulfuric acid; at 7 - 12 ℃; for 16h; Reflux;

Reference yield:

methanol (67-56-1) + 3-(methoxycarbonyl)-cyclopentane-1-carboxylic acid (84545-00-6) → cyclopentane?1,3?dimethyl formate (2435-36-1)

Guidance literature:

With sulfuric acid; at 70 ℃; for 2h;

Reference yield:

norborn-2-ene (498-66-8) → cyclopentane?1,3?dimethyl formate (2435-36-1)

Guidance literature:

Multi-step reaction with 2 steps

1: ruthenium trichloride; sodium periodate / water; ethyl acetate; acetonitrile / 5 - 39 °C / Industry scale

2: sulfuric acid / 16 h / 7 - 12 °C / Reflux

With ruthenium trichloride; sodium periodate; sulfuric acid; In water; ethyl acetate; acetonitrile;

upstream raw materials:

methanol

cyclopentane-1,3-dicarboxylic acid

norborn-2-ene

3-(methoxycarbonyl)-cyclopentane-1-carboxylic acid

Downstream raw materials:

bicyclo<2.2.1>heptane-1,4-dicarboxylic acid

methyl 3-formylcyclopentane-1-carboxylate

(+)-cis-(1R,3S)-3-hydroxymethyl-1-carbomethoxycyclopentane

3-(methoxycarbonyl)-cyclopentane-1-carboxylic acid

Refernces

• 1、 -. "SMALL MOLECULE INHIBITORS OF THE JAK FAMILY OF KINASES". Page/Page column 56; 57. . Retrieved 2020/01/08.
• 2、 -. "IMIDAZOPYRROLOPYRIDINE AS INHIBITORS OF THE JAK FAMILY OF KINASES". Page/Page column 174. . Retrieved 2018/07/05.