8-Methyl-quinoline-2,3-dicarboxylic acid diethyl ester

Base Information

• Chemical Name: 8-Methyl-quinoline-2,3-dicarboxylic acid diethyl ester
• CAS No.: 892874-76-9
• Molecular Formula: C16H17NO4
• Molecular Weight: 287.31
• DSSTox Substance ID: DTXSID80588896
• Wikidata: Q82481887
• Mol file: 892874-76-9.mol

Synonyms:892874-76-9;8-Methyl-quinoline-2,3-dicarboxylic acid diethyl ester;DIETHYL 8-METHYLQUINOLINE-2,3-DICARBOXYLATE;Diethyl 8-methyl-2,3-quinolinedicarboxylate;DTXSID80588896;MFCD08437584;AB45145;DB-078378

Chemical Property of 8-Methyl-quinoline-2,3-dicarboxylic acid diethyl ester

Chemical Property:

• Vapor Pressure: 3.3E-06mmHg at 25°C
• Boiling Point: 387.4°C at 760 mmHg
• PKA: 0.22±0.50(Predicted)
• Flash Point: 188.1°C
• PSA: 65.49000
• Density: 1.187g/cm³
• LogP: 2.89660
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 287.11575802
• Heavy Atom Count: 21
• Complexity: 385

Purity/Quality:

98%min ^*data from raw suppliers

8-METHYL-QUINOLINE-2,3-DICARBOXYLIC ACID DIETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC2=CC=CC(=C2N=C1C(=O)OCC)C

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