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59142-68-6,MFCD00672923
Catalog No.:AA00362U

59142-68-6 | 2-Bromo-4-fluorobenzaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$6.00   $4.00
- +
5g
98%
in stock  
$7.00   $5.00
- +
10g
98%
in stock  
$9.00   $6.00
- +
25g
98%
in stock  
$13.00   $9.00
- +
100g
98%
in stock  
$29.00   $20.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00362U
Chemical Name:
2-Bromo-4-fluorobenzaldehyde
CAS Number:
59142-68-6
Molecular Formula:
C7H4BrFO
Molecular Weight:
203.0085
MDL Number:
MFCD00672923
SMILES:
O=Cc1ccc(cc1Br)F
Properties
Properties
 
BP:
234.9°C at 760 mmHg  
Form:
Solid  
MP:
61.5 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
129  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.2  

Upstream Synthesis Route

[1]EuropeanJournalofOrganicChemistry,2014,vol.2014,#3,p.511-514

[2]EuropeanJournalofOrganicChemistry,2014,vol.2014,#3,p.511-514

[1]JournalofMedicinalChemistry,2015,vol.58,#9,p.3997-4015

[1]Synlett,2018,vol.29,#16,p.2185-2190

[2]OrganicandBiomolecularChemistry,2018,vol.16,#42,p.7959-7963

[1]Tetrahedron,2015,vol.71,#38,p.6744-6748

[2]Synthesis(Germany),2013,vol.45,#24,p.3387-3391

[1]Patent:WO2004/46133,2004,A1,.Locationinpatent:Page27

Downstream Synthesis Route

[1]Patent:US6340759,2002,B1.Locationinpatent:Example224

[2]JournalofMedicinalChemistry,1976,vol.19,p.1315-1324

[3]Patent:US3959475,1976,A

[4]BioorganicandMedicinalChemistryLetters,2008,vol.18,p.2696-2700

[1]Tetrahedron,2015,vol.71,p.6744-6748

[2]Synthesis,2013,vol.45,p.3387-3391

1422-53-3    59142-68-6    122-51-0   
2-bromo-4-fluoro-benzaldehydediethylacetal 

[1]Patent:US6080773,2000,A

ρ-toluenesulfonicacid 
  1422-53-3    59142-68-6    122-51-0   
2-bromo-4-fluoro-benzaldehydediethylacetal 

[1]Patent:EP898566,2002,B1

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2009/97578,2009,A1Locationinpatent:Page/Pagecolumn181-182

[2]CurrentPatentAssignee:LIGANDPHARMACEUTICALSINC-WO2007/41362,2007,A1Locationinpatent:Page/Pagecolumn37

[3]McBride,ChristopherM.;Levine,Barry;Xia,Yi;Bellamacina,Cornelia;Machajewski,Timothy;Gao,Zhenhai;Renhowe,Paul;Antonios-Mccrea,William;Barsanti,Paul;Brinner,Kristin;Costales,Abran;Doughan,Brandon;Lin,Xiaodong;Louie,Alicia;McKenna,Maureen;Mendenhall,Kris;Poon,Daniel;Rico,Alice;Wang,Michael;Williams,TeresaE.;Abrams,Tinya;Fong,Susan;Hendrickson,Thomas;Lei,Dachuan;Lin,Julie;Menezes,Daniel;Pryer,Nancy;Taverna,Pietro;Xu,Yongjin;Zhou,Yasheen;Shafer,CynthiaM.[JournalofMedicinalChemistry,2014,vol.57,#21,p.9124-9129]

Literature
Quotation Request
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Additional Info:
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SDS
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Tags:59142-68-6 Molecular Formula|59142-68-6 MDL|59142-68-6 SMILES|59142-68-6 2-Bromo-4-fluorobenzaldehyde
Catalog No.: AA00362U
59142-68-6,MFCD00672923
59142-68-6 | 2-Bromo-4-fluorobenzaldehyde
Pack Size： 1g
Purity： 98%
in stock
$6.00 $4.00
Pack Size： 5g
Purity： 98%
in stock
$7.00 $5.00
Pack Size： 10g
Purity： 98%
in stock
$9.00 $6.00
Pack Size： 25g
Purity： 98%
in stock
$13.00 $9.00
Pack Size： 100g
Purity： 98%
in stock
$29.00 $20.00
Quantity
- +
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Technical Information
Catalog Number: AA00362U
Chemical Name: 2-Bromo-4-fluorobenzaldehyde
CAS Number: 59142-68-6
Molecular Formula: C7H4BrFO
Molecular Weight: 203.0085
MDL Number: MFCD00672923
SMILES: O=Cc1ccc(cc1Br)F
Properties
BP: 234.9°C at 760 mmHg  
Form: Solid  
MP: 61.5 °C  
Storage: Keep in dry area;Room Temperature;  
Complexity: 129  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.2  
Upstream Synthesis Route
59142-68-6    623-33-6    348-37-8 

[1]EuropeanJournalofOrganicChemistry,2014,vol.2014,#3,p.511-514

[2]EuropeanJournalofOrganicChemistry,2014,vol.2014,#3,p.511-514

59142-68-6    23932-84-5 

[1]JournalofMedicinalChemistry,2015,vol.58,#9,p.3997-4015

59142-68-6    36282-26-5 

[1]Synlett,2018,vol.29,#16,p.2185-2190

[2]OrganicandBiomolecularChemistry,2018,vol.16,#42,p.7959-7963

229027-89-8    59142-68-6 

[1]Tetrahedron,2015,vol.71,#38,p.6744-6748

[2]Synthesis(Germany),2013,vol.45,#24,p.3387-3391

79-37-8    229027-89-8    59142-68-6 

[1]Patent:WO2004/46133,2004,A1,.Locationinpatent:Page27

Downstream Synthesis Route
1422-53-3    59142-68-6 

[1]Patent:US6340759,2002,B1.Locationinpatent:Example224

[2]JournalofMedicinalChemistry,1976,vol.19,p.1315-1324

[3]Patent:US3959475,1976,A

[4]BioorganicandMedicinalChemistryLetters,2008,vol.18,p.2696-2700

229027-89-8    59142-68-6 

[1]Tetrahedron,2015,vol.71,p.6744-6748

[2]Synthesis,2013,vol.45,p.3387-3391

1422-53-3    59142-68-6    122-51-0   
2-bromo-4-fluoro-benzaldehydediethylacetal 

[1]Patent:US6080773,2000,A

ρ-toluenesulfonicacid 
  1422-53-3    59142-68-6    122-51-0   
2-bromo-4-fluoro-benzaldehydediethylacetal 

[1]Patent:EP898566,2002,B1

59142-68-6    343338-28-3    1039750-61-2 

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2009/97578,2009,A1Locationinpatent:Page/Pagecolumn181-182

[2]CurrentPatentAssignee:LIGANDPHARMACEUTICALSINC-WO2007/41362,2007,A1Locationinpatent:Page/Pagecolumn37

[3]McBride,ChristopherM.;Levine,Barry;Xia,Yi;Bellamacina,Cornelia;Machajewski,Timothy;Gao,Zhenhai;Renhowe,Paul;Antonios-Mccrea,William;Barsanti,Paul;Brinner,Kristin;Costales,Abran;Doughan,Brandon;Lin,Xiaodong;Louie,Alicia;McKenna,Maureen;Mendenhall,Kris;Poon,Daniel;Rico,Alice;Wang,Michael;Williams,TeresaE.;Abrams,Tinya;Fong,Susan;Hendrickson,Thomas;Lei,Dachuan;Lin,Julie;Menezes,Daniel;Pryer,Nancy;Taverna,Pietro;Xu,Yongjin;Zhou,Yasheen;Shafer,CynthiaM.[JournalofMedicinalChemistry,2014,vol.57,#21,p.9124-9129]

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