1(2H)-Quinolinecarboxylic acid, isopropyl ester

Base Information

• Chemical Name: 1(2H)-Quinolinecarboxylic acid, isopropyl ester
• CAS No.: 17718-20-6
• Molecular Formula: C13H15NO2
• Molecular Weight: 0
• Hs Code.: 2933499090
• DSSTox Substance ID: DTXSID30170265
• Nikkaji Number: J48.213G
• Wikidata: Q83040169
• Mol file: 17718-20-6.mol

Synonyms:propan-2-yl 2H-quinoline-1-carboxylate;17718-20-6;1(2H)-Quinolinecarboxylic acid, isopropyl ester;1(2H)-Quinolinecarboxylic acid isopropyl ester;Isopropyl 1(2H)-quinolinecarboxylate;BRN 1286172;1(2H)-Quinolinecarboxylic acid, 1-methylethyl ester;SCHEMBL6110761;DTXSID30170265

Chemical Property of 1(2H)-Quinolinecarboxylic acid, isopropyl ester

Chemical Property:

• Vapor Pressure: 0.000393mmHg at 25°C
• Boiling Point: 317.1°C at 760 mmHg
• Flash Point: 145.6°C
• PSA: 29.54000
• Density: 1.133g/cm³
• LogP: 3.12980
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 217.110278721
• Heavy Atom Count: 16
• Complexity: 286

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(=O)N1CC=CC2=CC=CC=C21