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717880-58-5,MFCD01851253
Catalog No.:AA00FFBJ

717880-58-5 | Methyl 2-bromo-5-iodobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$19.00   $13.00
- +
1g
98%
in stock  
$26.00   $19.00
- +
5g
98%
in stock  
$70.00   $49.00
- +
25g
95%
in stock  
$278.00   $195.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00FFBJ
Chemical Name:
Methyl 2-bromo-5-iodobenzoate
CAS Number:
717880-58-5
Molecular Formula:
C8H6BrIO2
Molecular Weight:
340.9405
MDL Number:
MFCD01851253
SMILES:
COC(=O)c1cc(I)ccc1Br
Properties
Computed Properties
 
Complexity:
174  
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:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Downstream Synthesis Route

[1]Patent:WO2016/145479,2016,A1.Locationinpatent:Paragraph0125

[2]Patent:WO2004/48314,2004,A1.Locationinpatent:Page48-49

[1]CurrentPatentAssignee:OREXOAB-WO2010/103278,2010,A1Locationinpatent:Page/Pagecolumn82

[1]CurrentPatentAssignee:GILEADSCIENCESINC-WO2010/132601,2010,A1Locationinpatent:Page/Pagecolumn434

[1]ACSChemicalNeuroscience,2020

[2]Tetrahedron,2015,vol.71,p.283-292

[3]Patent:WO2010/132601,2010,A1.Locationinpatent:Page/Pagecolumn433-434

[1]CurrentPatentAssignee:OREXOAB-WO2011/110824,2011,A1Locationinpatent:Page/Pagecolumn76

[2]CurrentPatentAssignee:OREXOAB-US2013/35358,2013,A1Locationinpatent:Paragraph0187

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:717880-58-5 Molecular Formula|717880-58-5 MDL|717880-58-5 SMILES|717880-58-5 Methyl 2-bromo-5-iodobenzoate
Catalog No.: AA00FFBJ
717880-58-5,MFCD01851253
717880-58-5 | Methyl 2-bromo-5-iodobenzoate
Pack Size： 250mg
Purity： 98%
in stock
$19.00 $13.00
Pack Size： 1g
Purity： 98%
in stock
$26.00 $19.00
Pack Size： 5g
Purity： 98%
in stock
$70.00 $49.00
Pack Size： 25g
Purity： 95%
in stock
$278.00 $195.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00FFBJ
Chemical Name: Methyl 2-bromo-5-iodobenzoate
CAS Number: 717880-58-5
Molecular Formula: C8H6BrIO2
Molecular Weight: 340.9405
MDL Number: MFCD01851253
SMILES: COC(=O)c1cc(I)ccc1Br
Properties
Complexity: 174  
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: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
Downstream Synthesis Route
25252-00-0    74-88-4    717880-58-5 

[1]Patent:WO2016/145479,2016,A1.Locationinpatent:Paragraph0125

[2]Patent:WO2004/48314,2004,A1.Locationinpatent:Page48-49

717880-58-5    1245735-27-6 

[1]CurrentPatentAssignee:OREXOAB-WO2010/103278,2010,A1Locationinpatent:Page/Pagecolumn82

717880-58-5    97674-02-7    1256384-07-2 

[1]CurrentPatentAssignee:GILEADSCIENCESINC-WO2010/132601,2010,A1Locationinpatent:Page/Pagecolumn434

67-56-1    25252-00-0    717880-58-5 

[1]ACSChemicalNeuroscience,2020

[2]Tetrahedron,2015,vol.71,p.283-292

[3]Patent:WO2010/132601,2010,A1.Locationinpatent:Page/Pagecolumn433-434

717880-58-5    1244043-46-6    1245735-27-6 

[1]CurrentPatentAssignee:OREXOAB-WO2011/110824,2011,A1Locationinpatent:Page/Pagecolumn76

[2]CurrentPatentAssignee:OREXOAB-US2013/35358,2013,A1Locationinpatent:Paragraph0187

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