Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate

Base Information Edit

Chemical Name:Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate
CAS No.:85068-37-7
Molecular Formula:C23H28 O5
Molecular Weight:384.472
Hs Code.:2932190090
European Community (EC) Number:285-299-8,255-554-8
DSSTox Substance ID:DTXSID60961986
Nikkaji Number:J317.092F
Mol file:85068-37-7.mol

Synonyms:85068-37-7;Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate;41790-27-6;Propanoicacid, 1-(1-naphthalenyl)-3-(tetrahydro-2-furanyl)-, diethyl ester;diethyl 2-(naphthalen-1-ylmethyl)-2-(oxolan-2-ylmethyl)propanedioate;Diethyl 2-(naphthalen-1-ylmethyl)-2-((tetrahydrofuran-2-yl)methyl)malonate;(1-Naphthalenylmethyl)[(tetrahydro-2-furanyl)methyl]-propanedioic Acid Diethyl Ester;1,3-diethyl 2-[(naphthalen-1-yl)methyl]-2-[(oxolan-2-yl)methyl]propanedioate;XGSMOSALSJBVLR-UHFFFAOYSA-N;EINECS 285-299-8;DTXSID60961986;EINECS 255-554-8;AKOS005067987;NS00057037;Diethyl (1-naphthylmethyl)tetrahydrofurfurylmalonate;Diethyl(1-naphthylmethyl)(tetrahydrofurfuryl)malonate;Diethyl [(naphthalen-1-yl)methyl][(oxolan-2-yl)methyl]propanedioate

Suppliers and Price of Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate

Supply Marketing:Edit

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

TRC
(1-Naphthalenylmethyl)[(tetrahydro-2-furanyl)methyl]-propanedioicAcidDiethylEster
10g
$ 1190.00

Total 4 raw suppliers

Chemical Property of Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate Edit

Chemical Property:

Vapor Pressure:3.82E-10mmHg at 25°C
Boiling Point:500.4°Cat760mmHg
Flash Point:215.9°C
PSA：61.83000
Density:1.148g/cm³
LogP:4.06400
XLogP3:4.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:384.19367399
Heavy Atom Count:28
Complexity:513

Purity/Quality:

99% ^*data from raw suppliers

(1-Naphthalenylmethyl)[(tetrahydro-2-furanyl)methyl]-propanedioicAcidDiethylEster ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(CC1CCCO1)(CC2=CC=CC3=CC=CC=C32)C(=O)OCC
Uses (1-Naphthalenylmethyl)[(tetrahydro-2-furanyl)methyl]-propanedioic Acid Diethyl Ester is an intermediate in synthesizing Nafronyl (N215000), which is a selective inhibitor of serotonin receptors. Nafronyl is a vasodilator used in the treatment of intermittent claudication.

Technology Process of Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate

There total 7 articles about Diethyl (1-naphthylmethyl)(tetrahydrofurfuryl)malonate 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%

: 37136-39-3
diethyl 2-((tetrahydrofuran-2-yl)methyl)malonate

: 86-52-2
1-Chloromethylnaphthalene

: 85068-37-7
diethyl 1-(tetrahydro-2-furyl)-3-(1-naphthyl)propane-2,2-dicarboxylate

Guidance literature:: With sodium ethanolate; In ethanol;

Reference yield:

: 105-53-3
diethyl malonate

: 85068-37-7
diethyl 1-(tetrahydro-2-furyl)-3-(1-naphthyl)propane-2,2-dicarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 61 percent / sodium ethoxide / ethanol / Heating

2: 76 percent / sodium ethoxide / ethanol

With sodium ethanolate; In ethanol;

Reference yield:

: 98-01-1
furfural

: 85068-37-7
diethyl 1-(tetrahydro-2-furyl)-3-(1-naphthyl)propane-2,2-dicarboxylate

Guidance literature:: Multi-step reaction with 3 steps

1: 85 percent / piperidine, acetic acid / toluene / 1.) 100-104 deg C, 1.5 h, 2.) 110-120 deg C, 4 h.

2: 88 percent / hydrogen / Raney Ni / ethanol / 6 h / 80 °C / 56254.5 Torr

3: 76 percent / sodium ethoxide / ethanol

With piperidine; hydrogen; sodium ethanolate; acetic acid; nickel; In ethanol; toluene;