3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(3-(dimethylamino)propyl)-1-oxo-4-phenyl-

Base Information

• Chemical Name: 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(3-(dimethylamino)propyl)-1-oxo-4-phenyl-
• CAS No.: 112392-93-5
• Molecular Formula: C21H22 N2 O3
• Molecular Weight: 350.411
• DSSTox Substance ID: DTXSID10150020
• Wikidata: Q83015925
• Mol file: 112392-93-5.mol

Synonyms:112392-93-5;3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(3-(dimethylamino)propyl)-1-oxo-4-phenyl-;2-(3-(Dimethylamino)propyl)-1-oxo-4-phenyl-1,2-dihydro-3-isoquinolinecarboxylic acid;2-(3-(Dimethylamino)propyl)-1-oxo-4-phenyl-1,2-dihydroisoquinoline-3-carboxylic acid;DTXSID10150020;LS-85445

Chemical Property of 3-Isoquinolinecarboxylic acid, 1,2-dihydro-2-(3-(dimethylamino)propyl)-1-oxo-4-phenyl-

Chemical Property:

• Vapor Pressure: 7.32E-11mmHg at 25°C
• Boiling Point: 501.1°C at 760 mmHg
• Flash Point: 256.9°C
• Density: 1.234g/cm³
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 350.16304257
• Heavy Atom Count: 26
• Complexity: 564

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCCN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)C(=O)O