2-(4-bromophenyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone

Base Information

• Chemical Name: 2-(4-bromophenyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
• CAS No.: 6602-96-6
• Molecular Formula: C17H16BrNO
• Molecular Weight: 330.219
• DSSTox Substance ID: DTXSID20349988
• Nikkaji Number: J3.207.511H
• Wikidata: Q82125643
• ChEMBL ID: CHEMBL1528631

Synonyms:6602-96-6;ST043827;MLS001185513;CHEMBL1528631;DTXSID20349988;HMS2824I20;2-(4-bromophenyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone;STK069275;AKOS003281343;SMR000503152;SR-01000238462;SR-01000238462-1;2-(4-BROMOPHENYL)-1-(1,2,3,4-TETRAHYDROISOQUINOLIN-2-YL)ETHAN-1-ONE

Chemical Property of 2-(4-bromophenyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone

Chemical Property:

• Vapor Pressure: 4.8E-10mmHg at 25°C
• Boiling Point: 497.8°C at 760 mmHg
• Flash Point: 254.9°C
• Density: 1.402g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 329.04153
• Heavy Atom Count: 20
• Complexity: 338

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CC2=CC=CC=C21)C(=O)CC3=CC=C(C=C3)Br

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