Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate

Base Information

Chemical Name:Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate
CAS No.:55747-45-0
Molecular Formula:C17H19NO5
Molecular Weight:317.342
Hs Code.:2925190090
DSSTox Substance ID:DTXSID40399001
Nikkaji Number:J2.183.733D
Mol file:55747-45-0.mol

Synonyms:55747-45-0;Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate;Ethyl 2-(3-N-phthalimidopropyl)acetoacetate;ethyl 2-acetyl-5-(1,3-dioxoisoindol-2-yl)pentanoate;Ethyl acetopropylphthalimide;CBDivE_002266;SCHEMBL5526889;DTXSID40399001;XDGCOSMBEZEXSN-UHFFFAOYSA-N;AKOS024258415;SB64172;ethyl 2-(3-phthalimidopropyl)acetoacetate;ethyl alpha-acetyl-delta-phthalimidovalerate;CS-0361433;FT-0625858;2-Acetyl-5-phthalimidylvaleric acid ethyl ester;Ethyl2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate

Suppliers and Price of Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate

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

SynChem
ETHYL 2-(3-N-PHTHALIMIDOPROPYL)ACETOACETATE 95%
5 g
$ 62.00

Matrix Scientific
Ethyl2-(3-N-phthalimidopropyl)acetoacetate 95%
10g
$ 160.00

Crysdot
Ethyl2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate 95+%
25g
$ 301.00

Chemenu
Ethyl2-(3-N-phthalimidopropyl)acetoacetate 95%
25g
$ 284.00

American Custom Chemicals Corporation
ETHYL-2-(3-N-PHTHALIMIDOPROPYL)ACETOACETATE 95.00%
100G
$ 3054.98

Alichem
Ethyl2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate
25g
$ 400.00

Alfa Aesar
Ethyl 2-(3-N-phthalimidopropyl)acetoacetate, 95%
25g
$ 154.00

Alfa Aesar
Ethyl 2-(3-N-phthalimidopropyl)acetoacetate, 95%
5g
$ 43.00

AHH
Ethyl2-(3-N-phthalimidopropyl)acetoacetate 98%
100g
$ 428.00

Total 19 raw suppliers

Chemical Property of Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate

Chemical Property:

Vapor Pressure:4.17E-09mmHg at 25°C
Melting Point:62-64°C
Refractive Index:1.545
Boiling Point:472.7°Cat760mmHg
PKA:11.60±0.59(Predicted)
Flash Point:239.7°C
PSA：80.75000
Density:1.236g/cm³
LogP:1.76900
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:317.12632271
Heavy Atom Count:23
Complexity:477

Purity/Quality:

≥97% ^*data from raw suppliers

ETHYL 2-(3-N-PHTHALIMIDOPROPYL)ACETOACETATE 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: 22-24/25

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(CCCN1C(=O)C2=CC=CC=C2C1=O)C(=O)C
Uses Ethyl 2-Acetyl-5-phthalimidopentanoate is used in the synthesis of the serotonin receptor Zolmitriptan and it’s related compounds.

Technology Process of Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate

There total 11 articles about Ethyl 2-acetyl-5-(1,3-dioxoisoindolin-2-yl)pentanoate 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: 97.0%

: 5457-29-4
N-(3-iodopropyl)phthalimide

: 141-97-9
ethyl acetoacetate

: 55747-45-0
ethyl 2-acetyl-5-(1,3-dioxo-1,3-dihydro-2-isoindolyl)pentanoate

Guidance literature:: ethyl acetoacetate; With potassium carbonate; In acetone; for 1h; Reflux;

N-(3-iodopropyl)phthalimide; In acetone; for 255h; Reflux;

Reference yield: 96.2%

: 136918-14-4,85-41-6
phthalimide

: 141-97-9
ethyl acetoacetate

: 142-28-9
1,3-Dichloropropane

: 55747-45-0
ethyl 2-acetyl-5-(1,3-dioxo-1,3-dihydro-2-isoindolyl)pentanoate

Guidance literature:: phthalimide; With potassium carbonate; In acetonitrile; at 20 ℃; for 0.5h;

1,3-Dichloropropane; With sodium iodide; In acetonitrile; at 58 - 60 ℃; for 5.5h;

ethyl acetoacetate; In acetonitrile; at 20 ℃; for 7h; Reagent/catalyst;