3-Isoquinolinecarboxylic acid, 4-methyl-1-(4-morpholinyl)-, methyl ester

Base Information

• Chemical Name: 3-Isoquinolinecarboxylic acid, 4-methyl-1-(4-morpholinyl)-, methyl ester
• CAS No.: 89928-79-0
• Molecular Formula: C16H18N2O3
• Molecular Weight: 286.3257
• DSSTox Substance ID: DTXSID80237938
• Wikidata: Q83120208
• Mol file: 89928-79-0.mol

Synonyms:89928-79-0;Methyl 4-methyl-1-(4-morpholinyl)-3-isoquinolinecarboxylate;3-Isoquinolinecarboxylic acid, 4-methyl-1-(4-morpholinyl)-, methyl ester;4-methyl-1-(4-morpholinyl)-3-isoquinolinecarboxylic acid methyl ester;DTXSID80237938;LS-85451

Chemical Property of 3-Isoquinolinecarboxylic acid, 4-methyl-1-(4-morpholinyl)-, methyl ester

Chemical Property:

• Vapor Pressure: 2.8E-10mmHg at 25°C
• Boiling Point: 503.9°Cat760mmHg
• Flash Point: 258.5°C
• Density: 1.222g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 286.13174244
• Heavy Atom Count: 21
• Complexity: 371

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N=C(C2=CC=CC=C12)N3CCOCC3)C(=O)OC