Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate

Base Information

Chemical Name:Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate
CAS No.:87698-94-0
Molecular Formula:C16H19NO4
Molecular Weight:289.331
Hs Code.:
DSSTox Substance ID:DTXSID00530539
Nikkaji Number:J2.226.111H

Synonyms:87698-94-0;DTXSID00530539;Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate

Suppliers and Price of Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate

Supply Marketing:

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

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Chemical Property of Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:289.13140809
Heavy Atom Count:21
Complexity:395

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C(=CC1=CC=CC=C1N2CCCC2)C(=O)OC

Technology Process of Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate

There total 2 articles about Dimethyl {[2-(pyrrolidin-1-yl)phenyl]methylidene}propanedioate 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: 76.0%

: 58028-74-3
2-pyrrolidin-1-ylbenzaldehyde

: 108-59-8
malonic acid dimethyl ester

: 87698-94-0
Dimethyl <2-(1-Pyrrolidinyl)phenylmethylene>propanedioate

Guidance literature:: pyrrolidine; In benzene; for 18h; Heating;
DOI:10.1021/jo00176a011

Reference yield:

: 446-52-6
2-Fluorobenzaldehyde

: 87698-94-0
Dimethyl <2-(1-Pyrrolidinyl)phenylmethylene>propanedioate

Guidance literature:: Multi-step reaction with 2 steps

1: 95 percent / K₂CO₃ / dimethylformamide / 20 h / 150 °C

With potassium carbonate; In N,N-dimethyl-formamide; 2: Knoevenagel condensation;
DOI:10.1023/B:RUCB.0000042280.71728.d0