Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate

Base Information

Chemical Name:Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate
CAS No.:50469-23-3
Molecular Formula:C25H28 N2 O6
Molecular Weight:452.507
Hs Code.:2933990090
European Community (EC) Number:256-598-0
NSC Number:17820
DSSTox Substance ID:DTXSID40198495
Nikkaji Number:J26.798H
Wikidata:Q83071261
Mol file:50469-23-3.mol

Synonyms:50469-23-3;EINECS 256-598-0;Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate;C25H28N2O6;NSC17820;DTXSID40198495;NSC 17820;NSC-17820;C25-H28-N2-O6;2-Acetylamino-2-(5-benzyloxy-1H-indol-3-ylmethyl)malonic acid diethyl ester

Suppliers and Price of Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate

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 6 raw suppliers

Chemical Property of Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate

Chemical Property:

Vapor Pressure:3.72E-17mmHg at 25°C
Boiling Point:657.4°C at 760 mmHg
Flash Point:351.4°C
PSA：106.72000
Density:1.241g/cm³
LogP:3.68140
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:12
Exact Mass:452.19473662
Heavy Atom Count:33
Complexity:660

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3)(C(=O)OCC)NC(=O)C

Technology Process of Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)malonate

There total 3 articles about Diethyl 2-acetamido-2-((5-(phenylmethoxy)indol-3-yl)methyl)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:

: 1453-97-0
5-benzyloxygramine

: 1068-90-2
2-acetylaminomalonic acid diethyl ester

: 50469-23-3
acetylamino-(5-benzyloxy-indol-3-ylmethyl)-malonic acid diethyl ester

Guidance literature:: With sodium hydroxide; toluene;
DOI:10.1021/jo01084a008

Reference yield:

: 51145-58-5
[4-(benzyloxy)phenyl]hydrazine

: 107-02-8,25068-14-8
acrolein

: 1068-90-2
2-acetylaminomalonic acid diethyl ester

: 50469-23-3
acetylamino-(5-benzyloxy-indol-3-ylmethyl)-malonic acid diethyl ester

Guidance literature:: With ethanol; sodium ethanolate; acetic acid; Erwaermen des Reaktionsgemisches mit konz. H₂SO₄;
DOI:10.1139/v59-200

Reference yield:

: 50469-23-3
acetylamino-(5-benzyloxy-indol-3-ylmethyl)-malonic acid diethyl ester

Guidance literature:: Acetylaminomalonester, Methylenchlorid, 1. Acrolein, Methylenchlorid, Natriummethylatlsg., 2. γ-Acetylamino-γ,γ-dicarbethoxy-butyraldehyd, 3. 4-Benzyloxy-phenylhydrazin, (kochen), 4. Sulfosalicylsaeure;

upstream raw materials:

5-benzyloxygramine

2-acetylaminomalonic acid diethyl ester

[4-(benzyloxy)phenyl]hydrazine

acrolein

Downstream raw materials:

acetylamino-(5-benzyloxy-indol-3-ylmethyl)-malonic acid

(+/-)-N-Acetyl-5-benzyloxy-tryptophan

5-Benzyloxy-tryptophan

N-acetyl-5-hydroxy-tryptophan

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