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197846-06-3,MFCD09879944
Catalog No.:AA002B1B

197846-06-3 | Methyl 2-bromo-3-furoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$107.00   $75.00
- +
1g
95%
in stock  
$203.00   $142.00
- +
5g
95%
in stock  
$780.00   $546.00
- +
25g
95%
in stock  
$3,451.00 $2,416.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002B1B
Chemical Name:
Methyl 2-bromo-3-furoate
CAS Number:
197846-06-3
Molecular Formula:
C6H5BrO3
Molecular Weight:
205.0061
MDL Number:
MFCD09879944
SMILES:
COC(=O)c1ccoc1Br
Properties
Properties
 
BP:
205.02°C at 760 mmHg  
Form:
Solid  
MP:
49.5-51.5 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
137  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Johansson,Gary[JournalofMedicinalChemistry,1997,vol.40,#23,p.3804-3819]

[1]CurrentPatentAssignee:MERCK&COINC-WO2005/103020,2005,A1Locationinpatent:Page/Pagecolumn86

[1]Demmer,CharlesS.;Rombach,David;Liu,Na;Nielsen,Birgitte;Pickering,DarrylS.;Bunch,Lennart[ACSChemicalNeuroscience,2017,vol.8,#11,p.2477-2495]

[2]CurrentPatentAssignee:THERAVANCEBIOPHARMA,INC.-US2011/230495,2011,A1Locationinpatent:Page/Pagecolumn31-32

[1]Dydio,Pawel;Reek,JoostN.H.[AngewandteChemie-InternationalEdition,2013,vol.52,#14,p.3878-3882][Angew.Chem.,2013,vol.125,#14,p.4132]

[1]Varni,AnthonyJ.;Fortney,Andria;Baker,MatthewA.;Worch,JoshuaC.;Qiu,Yunyan;Yaron,David;Bernhard,Stefan;Noonan,KevinJ.T.;Kowalewski,Tomasz[JournaloftheAmericanChemicalSociety,2019,vol.141,#22,p.8858-8867]

Literature
Quotation Request
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SDS
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Tags:197846-06-3 Molecular Formula|197846-06-3 MDL|197846-06-3 SMILES|197846-06-3 Methyl 2-bromo-3-furoate
Catalog No.: AA002B1B
197846-06-3,MFCD09879944
197846-06-3 | Methyl 2-bromo-3-furoate
Pack Size： 250mg
Purity： 95%
in stock
$107.00 $75.00
Pack Size： 1g
Purity： 95%
in stock
$203.00 $142.00
Pack Size： 5g
Purity： 95%
in stock
$780.00 $546.00
Pack Size： 25g
Purity： 95%
in stock
$3,451.00 $2,416.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA002B1B
Chemical Name: Methyl 2-bromo-3-furoate
CAS Number: 197846-06-3
Molecular Formula: C6H5BrO3
Molecular Weight: 205.0061
MDL Number: MFCD09879944
SMILES: COC(=O)c1ccoc1Br
Properties
BP: 205.02°C at 760 mmHg  
Form: Solid  
MP: 49.5-51.5 °C  
Storage: Keep in dry area;2-8℃;  
Complexity: 137  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 3  
Rotatable Bond Count: 2  
XLogP3: 1.9  
Downstream Synthesis Route
197846-05-2    77-78-1    197846-06-3 

[1]Johansson,Gary[JournalofMedicinalChemistry,1997,vol.40,#23,p.3804-3819]

197846-06-3    868286-61-7 

[1]CurrentPatentAssignee:MERCK&COINC-WO2005/103020,2005,A1Locationinpatent:Page/Pagecolumn86

67-56-1    197846-05-2    197846-06-3 

[1]Demmer,CharlesS.;Rombach,David;Liu,Na;Nielsen,Birgitte;Pickering,DarrylS.;Bunch,Lennart[ACSChemicalNeuroscience,2017,vol.8,#11,p.2477-2495]

[2]CurrentPatentAssignee:THERAVANCEBIOPHARMA,INC.-US2011/230495,2011,A1Locationinpatent:Page/Pagecolumn31-32

197846-05-2    18107-18-1    197846-06-3 

[1]Dydio,Pawel;Reek,JoostN.H.[AngewandteChemie-InternationalEdition,2013,vol.52,#14,p.3878-3882][Angew.Chem.,2013,vol.125,#14,p.4132]

197846-05-2    74-88-4    197846-06-3 

[1]Varni,AnthonyJ.;Fortney,Andria;Baker,MatthewA.;Worch,JoshuaC.;Qiu,Yunyan;Yaron,David;Bernhard,Stefan;Noonan,KevinJ.T.;Kowalewski,Tomasz[JournaloftheAmericanChemicalSociety,2019,vol.141,#22,p.8858-8867]

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