885521-60-8,MFCD07781589
Catalog No.:AA00GZO9

885521-60-8 | 3-Bromo-4-fluoro-1H-indazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$83.00   $58.00
- +
5g
95%
in stock  
$305.00 $214.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00GZO9
Chemical Name:
3-Bromo-4-fluoro-1H-indazole
CAS Number:
885521-60-8
Molecular Formula:
C7H4BrFN2
Molecular Weight:
215.0225
MDL Number:
MFCD07781589
SMILES:
Fc1cccc2c1c(Br)n[nH]2
Properties
Computed Properties
 
Complexity:
155  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
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:
2.7  

Downstream Synthesis Route
2-chloro-6-(trifluoromethyl)benzoylchloride 
  885521-60-8    1561771-60-5 

[1]CurrentPatentAssignee:MERCK&COINC-WO2014/28600,2014,A2Locationinpatent:Page/Pagecolumn49;50

[2]CurrentPatentAssignee:MERCK&COINC-WO2014/26328,2014,A1Locationinpatent:Page/Pagecolumn39

[3]CurrentPatentAssignee:MERCK&COINC-WO2014/26330,2014,A1Locationinpatent:Page/Pagecolumn39

[4]CurrentPatentAssignee:MERCK&COINC-WO2014/28600,2014,A2Locationinpatent:Page/Pagecolumn42

[5]CurrentPatentAssignee:MERCK&COINC-US2015/191434,2015,A1Locationinpatent:Paragraph0268

[1]Patent:WO2014/26328,2014,A1.Locationinpatent:Page/Pagecolumn39

[2]Patent:WO2014/28597,2014,A2.Locationinpatent:Page/Pagecolumn45

[3]Patent:WO2014/26330,2014,A1.Locationinpatent:Page/Pagecolumn38-39

[4]Patent:WO2014/28600,2014,A2.Locationinpatent:Page/Pagecolumn42

[5]Patent:US2015/191434,2015,A1.Locationinpatent:Paragraph0267

[1]CurrentPatentAssignee:MERCK&COINC-WO2014/28600,2014,A2

[1]CurrentPatentAssignee:MERCK&COINC-WO2014/28589,2014,A2Locationinpatent:Page/Pagecolumn74

Literature
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Tags:885521-60-8 Molecular Formula|885521-60-8 MDL|885521-60-8 SMILES|885521-60-8 3-Bromo-4-fluoro-1H-indazole
Catalog No.: AA00GZO9
885521-60-8,MFCD07781589
885521-60-8 | 3-Bromo-4-fluoro-1H-indazole
Pack Size: 1g
Purity: 95%
in stock
$83.00 $58.00
Pack Size: 5g
Purity: 95%
in stock
$305.00 $214.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00GZO9
Chemical Name: 3-Bromo-4-fluoro-1H-indazole
CAS Number: 885521-60-8
Molecular Formula: C7H4BrFN2
Molecular Weight: 215.0225
MDL Number: MFCD07781589
SMILES: Fc1cccc2c1c(Br)n[nH]2
Properties
Complexity: 155  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
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: 2.7  
Downstream Synthesis Route
2-chloro-6-(trifluoromethyl)benzoylchloride 
  885521-60-8    1561771-60-5 

[1]CurrentPatentAssignee:MERCK&COINC-WO2014/28600,2014,A2Locationinpatent:Page/Pagecolumn49;50

[2]CurrentPatentAssignee:MERCK&COINC-WO2014/26328,2014,A1Locationinpatent:Page/Pagecolumn39

[3]CurrentPatentAssignee:MERCK&COINC-WO2014/26330,2014,A1Locationinpatent:Page/Pagecolumn39

[4]CurrentPatentAssignee:MERCK&COINC-WO2014/28600,2014,A2Locationinpatent:Page/Pagecolumn42

[5]CurrentPatentAssignee:MERCK&COINC-US2015/191434,2015,A1Locationinpatent:Paragraph0268

341-23-1    885521-60-8 

[1]Patent:WO2014/26328,2014,A1.Locationinpatent:Page/Pagecolumn39

[2]Patent:WO2014/28597,2014,A2.Locationinpatent:Page/Pagecolumn45

[3]Patent:WO2014/26330,2014,A1.Locationinpatent:Page/Pagecolumn38-39

[4]Patent:WO2014/28600,2014,A2.Locationinpatent:Page/Pagecolumn42

[5]Patent:US2015/191434,2015,A1.Locationinpatent:Paragraph0267

885521-60-8    1561769-37-6 

[1]CurrentPatentAssignee:MERCK&COINC-WO2014/28600,2014,A2

885521-60-8    1561771-96-7    1562995-64-5 

[1]CurrentPatentAssignee:MERCK&COINC-WO2014/28589,2014,A2Locationinpatent:Page/Pagecolumn74

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