Methyl 2-(3-bromophenyl)quinoline-4-carboxylate

Base Information

• Chemical Name: Methyl 2-(3-bromophenyl)quinoline-4-carboxylate
• CAS No.: 350989-85-4
• Molecular Formula: C17H12BrNO2
• Molecular Weight: 342.18700
• Hs Code.: 2933499090
• DSSTox Substance ID: DTXSID20358010
• Nikkaji Number: J2.253.401G
• Wikidata: Q82138255
• Mol file: 350989-85-4.mol

Synonyms:methyl 2-(3-bromophenyl)quinoline-4-carboxylate;350989-85-4;2-(3-BROMO-PHENYL)-QUINOLINE-4-CARBOXYLIC ACID METHYL ESTER;MFCD01922105;CBMicro_049421;Oprea1_302453;2-(3-bromophenyl)quinoline-4-carboxylic acid methyl ester;DTXSID20358010;STK398530;AKOS003267899;BIM-0049506.P001;EU-0006470;SR-01000447129;SR-01000447129-1;2-(3-bromophenyl)-quinoline-4-carboxylic acid methyl ester

Chemical Property of Methyl 2-(3-bromophenyl)quinoline-4-carboxylate

Chemical Property:

• Vapor Pressure: 9.62E-09mmHg at 25°C
• Boiling Point: 462.7oC at 760 mmHg
• PKA: 2.22±0.33(Predicted)
• Flash Point: 233.7oC
• PSA: 39.19000
• Density: 1.449g/cm3
• LogP: 4.45090
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 341.00514
• Heavy Atom Count: 21
• Complexity: 376

Purity/Quality:

NLT 98% ^*data from raw suppliers

2-(3-BROMO-PHENYL)-QUINOLINE-4-CARBOXYLIC ACID METHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=CC=C3)Br