53472-18-7,MFCD01571832
Catalog No.:AA00D9C8

53472-18-7 | 5-Bromo-quinolin-8-ylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$11.00   $8.00
- +
1g
97%
in stock  
$26.00   $19.00
- +
5g
97%
in stock  
$60.00   $42.00
- +
10g
97%
in stock  
$116.00   $81.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00D9C8
Chemical Name:
5-Bromo-quinolin-8-ylamine
CAS Number:
53472-18-7
Molecular Formula:
C9H7BrN2
Molecular Weight:
223.0693
MDL Number:
MFCD01571832
SMILES:
Brc1ccc(c2c1cccn2)N
Properties
Properties
 
BP:
353.3°C at 760 mmHg  
Form:
Solid  
MP:
109-110℃  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
163  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Upstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,2019,p.290-320

[2]Patent:EP3401309,2018,A1,.Locationinpatent:Paragraph0859

[3]Patent:WO2010/30722,2010,A1,.Locationinpatent:Page/Pagecolumn46

[4]Patent:WO2016/77240,2016,A2,.Locationinpatent:Page/Pagecolumn90;104

[1]ChemicalScience,2018,vol.9,#7,p.1782-1788

[2]LettersinDrugDesignandDiscovery,2017,vol.14,#12,p.1415-1424

[1]JournalfuerPraktischeChemie(Leipzig),1889,vol.<2>40,p.386

[2]JournalfuerPraktischeChemie(Leipzig),1893,vol.<2>48,p.269

[1]Patent:CN108530443,2018,A,.Locationinpatent:Paragraph0058;0060-0062

[1]JournaloftheChemicalSociety,1946,p.155

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1946,p.155

[1]JournalfurpraktischeChemie(Leipzig1954),1889,vol.<2>40,p.386    JournalfuerPraktischeChemie(Leipzig),1893,vol.<2>48,p.269

5-bromo-8-acetylamino-quinoline 
  53472-18-7 

[1]JournalfurpraktischeChemie(Leipzig1954),1896,vol.<2>53,p.392

53472-18-7    292638-85-8   
3-(5-bromo-quinolin-8-ylamino)-propionicacidmethylester 

[1]ChemistryofHeterocyclicCompounds,2000,vol.36,p.432-438

Literature
Quotation Request
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Additional Info:
SDS
Tags:53472-18-7 Molecular Formula|53472-18-7 MDL|53472-18-7 SMILES|53472-18-7 5-Bromo-quinolin-8-ylamine
Catalog No.: AA00D9C8
53472-18-7,MFCD01571832
53472-18-7 | 5-Bromo-quinolin-8-ylamine
Pack Size: 250mg
Purity: 97%
in stock
$11.00 $8.00
Pack Size: 1g
Purity: 97%
in stock
$26.00 $19.00
Pack Size: 5g
Purity: 97%
in stock
$60.00 $42.00
Pack Size: 10g
Purity: 97%
in stock
$116.00 $81.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00D9C8
Chemical Name: 5-Bromo-quinolin-8-ylamine
CAS Number: 53472-18-7
Molecular Formula: C9H7BrN2
Molecular Weight: 223.0693
MDL Number: MFCD01571832
SMILES: Brc1ccc(c2c1cccn2)N
Properties
BP: 353.3°C at 760 mmHg  
Form: Solid  
MP: 109-110℃  
Storage: Inert atmosphere;2-8℃;  
Complexity: 163  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Upstream Synthesis Route
578-66-5    53472-18-7 

[1]EuropeanJournalofMedicinalChemistry,2019,p.290-320

[2]Patent:EP3401309,2018,A1,.Locationinpatent:Paragraph0859

[3]Patent:WO2010/30722,2010,A1,.Locationinpatent:Page/Pagecolumn46

[4]Patent:WO2016/77240,2016,A2,.Locationinpatent:Page/Pagecolumn90;104

578-66-5    53472-18-7    36107-02-5 

[1]ChemicalScience,2018,vol.9,#7,p.1782-1788

[2]LettersinDrugDesignandDiscovery,2017,vol.14,#12,p.1415-1424

176967-80-9    53472-18-7 

[1]JournalfuerPraktischeChemie(Leipzig),1889,vol.<2>40,p.386

[2]JournalfuerPraktischeChemie(Leipzig),1893,vol.<2>48,p.269

53472-18-7    504-63-2    40000-20-2 

[1]Patent:CN108530443,2018,A,.Locationinpatent:Paragraph0058;0060-0062

53472-18-7    56-81-5    40000-20-2 

[1]JournaloftheChemicalSociety,1946,p.155

Downstream Synthesis Route
53472-18-7    56-81-5    40000-20-2 

[1]JournaloftheChemicalSociety,1946,p.155

176967-80-9    53472-18-7 

[1]JournalfurpraktischeChemie(Leipzig1954),1889,vol.<2>40,p.386    JournalfuerPraktischeChemie(Leipzig),1893,vol.<2>48,p.269

5-bromo-8-acetylamino-quinoline 
  53472-18-7 

[1]JournalfurpraktischeChemie(Leipzig1954),1896,vol.<2>53,p.392

53472-18-7    292638-85-8   
3-(5-bromo-quinolin-8-ylamino)-propionicacidmethylester 

[1]ChemistryofHeterocyclicCompounds,2000,vol.36,p.432-438

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