4-(2-Quinoxalinylamino)benzoic acid ethyl ester

Base Information

• Chemical Name: 4-(2-Quinoxalinylamino)benzoic acid ethyl ester
• CAS No.: 361390-39-8
• Molecular Formula: C17H15N3O2
• Molecular Weight: 293.32
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID70363270
• Wikidata: Q27197946
• ChEMBL ID: CHEMBL1575677
• Mol file: 361390-39-8.mol

Synonyms:ethyl 4-(quinoxalin-2-ylamino)benzoate;361390-39-8;4-(2-Quinoxalinylamino)benzoic acid ethyl ester;ethyl 4-(2-quinoxalinylamino)benzenecarboxylate;MLS000720674;SMR000336417;ethyl 4-[(quinoxalin-2-yl)amino]benzoate;HMS2740J09;CHEMBL1575677;BDBM76548;cid_1482857;DTXSID70363270;CHEBI:115608;MFCD03787146;AKOS005076326;ethyl4-(quinoxalin-2-ylamino)benzoate;AC-14660;CS-0361552;FT-0714493;4-(quinoxalin-2-ylamino)benzoic acid ethyl ester;10T-0022;Q27197946

Chemical Property of 4-(2-Quinoxalinylamino)benzoic acid ethyl ester

Chemical Property:

• Vapor Pressure: 8.9E-09mmHg at 25°C
• Refractive Index: 1.669
• Boiling Point: 463.7 °C at 760 mmHg
• PKA: 1.67±0.59(Predicted)
• Flash Point: 234.2 °C
• PSA: 64.11000
• Density: 1.272 g/cm³
• LogP: 3.62310
• Storage Temp.: 2-8°C
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 293.116426730
• Heavy Atom Count: 22
• Complexity: 369

Purity/Quality:

99% ^*data from raw suppliers

Ethyl 4-(2-quinoxalinylamino)benzenecarboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2

Technology Process of 4-(2-Quinoxalinylamino)benzoic acid ethyl ester

There total 1 articles about 4-(2-Quinoxalinylamino)benzoic acid ethyl ester 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:

2-chloroquinoxaline (1448-87-9) + p-aminoethylbenzoate (94-09-7) → 4-quinoxalin-2-ylamino-benzoic acid ethyl ester (361390-39-8)

Guidance literature:

With hydrogenchloride; water;

DOI:10.1021/ja01629a072

upstream raw materials:

2-chloroquinoxaline

p-aminoethylbenzoate