Diethyl N-(4-nitrobenzoyl)-L-glutamate

Base Information

• Chemical Name: Diethyl N-(4-nitrobenzoyl)-L-glutamate
• CAS No.: 7148-24-5
• Molecular Formula: C16H20 N2 O7
• Molecular Weight: 352.344
• European Community (EC) Number: 230-464-1
• NSC Number: 5144
• Mol file: 7148-24-5.mol

Synonyms:NSC5144;SCHEMBL7954572;NSC 5144;NSC-5144;EINECS 230-464-1;MB02319;Diethyl N-(4-nitrobenzoyl)-L-glutamate;FT-0636365;DIETHYL-N-(4-NITROBENZOYL)-D-GLUTAMATE

Chemical Property of Diethyl N-(4-nitrobenzoyl)-L-glutamate

Chemical Property:

• Vapor Pressure: 1.44E-11mmHg at 25°C
• Melting Point: 92-94 °C(lit.)
• Refractive Index: 1.5800 (estimate)
• Boiling Point: 536.2oC at 760 mmHg
• PKA: 11.67±0.46(Predicted)
• Flash Point: 278.1oC
• Density: 1.253g/cm3
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 352.12705098
• Heavy Atom Count: 25
• Complexity: 481

Purity/Quality:

99% ^*data from raw suppliers

N-(4-Nitrobenzoyl)-L-glutamic acid diethyl ester 98% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Technology Process of Diethyl N-(4-nitrobenzoyl)-L-glutamate

There total 5 articles about Diethyl N-(4-nitrobenzoyl)-L-glutamate 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:

diethyl 2-aminopentanedioate (55895-85-7) + 4-nitro-benzoic acid (62-23-7) → N-<4-Nitro-benzoyl>-DL-glutaminsaeure-diaethylester (7148-24-5,94232-68-5)

Guidance literature:

Multistep reaction; (i) ClCO₂Et, Et₃N, diglyme, (ii) /BRN= 1726670/;

DOI:10.1002/jps.2600531118

Reference yield:

p-Nitrobenzoyl-L-(+)-glutamic acid (6758-40-3) → diethyl (4-nitrobenzoyl)-L-glutamate (7148-24-5)

Guidance literature:

DOI:10.1021/ja01175a011

Reference yield:

4-nitro-benzoyl chloride (122-04-3) → diethyl (4-nitrobenzoyl)-L-glutamate (7148-24-5)

Guidance literature:

With benzene;

DOI:10.1007/BF03190402

upstream raw materials:

hydrogenchloride

p-Nitrobenzoyl-L-(+)-glutamic acid

4-nitro-benzoyl chloride

L-glutamic acid

Downstream raw materials:

N-<4-(2-Hydroxy-indanyl-(1)-amino)-benzoyl>-DL-glutaminsaeure-diaethylester

N-(4-aminobenzoyl)-L-glutamic acid

(2S,4S)-4-methylglutamic acid

(2S,4R)-4-methylglutamic acid

Refernces

• 1、 SAM,SNAPP Jr.. "POTENTIAL ANTINEOPLASTIC AGENTS DERIVED FROM 1,2-EPOXYINDAN.". . p. 1364 - 1367. Retrieved 2007/10/06.