Dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-dicarboxylate

Base Information

Chemical Name:Dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-dicarboxylate
CAS No.:4407-32-3
Molecular Formula:C17H25NO4
Molecular Weight:307.3847
Hs Code.:
NSC Number:174575
DSSTox Substance ID:DTXSID70419387
Wikidata:Q82230372

Synonyms:NSC174575;4407-32-3;DTXSID70419387;AKOS024321372;NSC-174575;dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-dicarboxylate

Suppliers and Price of Dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-dicarboxylate

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

Total 3 raw suppliers

Chemical Property of Dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-dicarboxylate

Chemical Property:

Vapor Pressure:4.48E-07mmHg at 25°C
Boiling Point:414.4°Cat760mmHg
Flash Point:204.4°C
Density:1.143g/cm³
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:307.17835828
Heavy Atom Count:22
Complexity:487

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CCCCCCC(=C1C(=O)OC)N2CCCC2
Isomeric SMILES:COC(=O)/C/1=C/CCCCC/C(=C1/C(=O)OC)/N2CCCC2

Technology Process of Dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-dicarboxylate

There total 5 articles about Dimethyl 3-(1-pyrrolidinyl)-2,9-cyclononadiene-1,2-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: 91.0%

: 14092-11-6
1-pyrrolidino-1-cycloheptene

: 762-42-5
dimethyl acetylenedicarboxylate

: 88477-26-3,4407-32-3
dimethyl 3-(1-pyrrolidinyl)-cis,cis-2,9-cyclononadiene-1,2-dicarboxylate

Guidance literature:: In diethyl ether; at 30 - 35 ℃;
DOI:10.1021/ja00388a090

Reference yield: 91.0%

: 14092-11-6
1-pyrrolidino-1-cycloheptene

: 762-42-5
dimethyl acetylenedicarboxylate

: 42205-54-9,4407-32-3
dimethyl 3-(1-pirrolidinyl)-cis,trans-2,9-cyclononadiene-1,2-dicarboxylate

Guidance literature:: In diethyl ether; at 25 - 30 ℃; for 0.5h;
DOI:10.1021/ja00317a029

Reference yield:

: 762-42-5
dimethyl acetylenedicarboxylate

: 88477-26-3,4407-32-3
dimethyl 3-(1-pyrrolidinyl)-cis,cis-2,9-cyclononadiene-1,2-dicarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 91 percent / diethyl ether / 0.5 h / 25 - 30 °C

2: benzene-d6 / 5.5 h / Irradiation

In diethyl ether; benzene-d6;
DOI:10.1021/ja00317a029