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52240-28-5,MFCD08276248
Catalog No.:AA00I99Q

52240-28-5 | 4-(5-Bromo-2-thienyl)-4-oxobutyric acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$36.00   $25.00
- +
5g
95%
in stock  
$86.00   $60.00
- +
25g
95%
in stock  
$349.00   $244.00
- +
100g
95%
in stock  
$1,229.00   $860.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00I99Q
Chemical Name:
4-(5-Bromo-2-thienyl)-4-oxobutyric acid
CAS Number:
52240-28-5
Molecular Formula:
C8H7BrO3S
Molecular Weight:
263.1084
MDL Number:
MFCD08276248
SMILES:
OC(=O)CCC(=O)c1ccc(s1)Br
Properties
Computed Properties
 
Complexity:
219  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.1  

Upstream Synthesis Route

[1]JournalofOrganicChemistry,2001,vol.66,#22,p.7283-7286

[2]OrganicSyntheses,2002,vol.79,p.204-204

[3]JournaloftheChemicalSociety,1954,p.4162,4165

[4]RecueildesTravauxChimiquesdesPays-Bas,1950,vol.69,p.1083,1103

[5]NipponKagakuZasshi,1957,vol.78,p.779,783

[6]Chem.Abstr.,1960,p.22559

[1]Patent:US4299769,1981,A,

[1]ChemistryofHeterocyclicCompounds,2011,vol.46,#10,p.1199-1207

[1]ChemistryofHeterocyclicCompounds,2011,vol.46,#10,p.1199-1207

[1]ChemistryofHeterocyclicCompounds,2011,vol.46,#10,p.1199-1207

Literature
Quotation Request
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Quantity Required:
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Additional Info:
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SDS
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Tags:52240-28-5 Molecular Formula|52240-28-5 MDL|52240-28-5 SMILES|52240-28-5 4-(5-Bromo-2-thienyl)-4-oxobutyric acid
Catalog No.: AA00I99Q
52240-28-5,MFCD08276248
52240-28-5 | 4-(5-Bromo-2-thienyl)-4-oxobutyric acid
Pack Size： 1g
Purity： 95%
in stock
$36.00 $25.00
Pack Size： 5g
Purity： 95%
in stock
$86.00 $60.00
Pack Size： 25g
Purity： 95%
in stock
$349.00 $244.00
Pack Size： 100g
Purity： 95%
in stock
$1,229.00 $860.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00I99Q
Chemical Name: 4-(5-Bromo-2-thienyl)-4-oxobutyric acid
CAS Number: 52240-28-5
Molecular Formula: C8H7BrO3S
Molecular Weight: 263.1084
MDL Number: MFCD08276248
SMILES: OC(=O)CCC(=O)c1ccc(s1)Br
Properties
Complexity: 219  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.1  
Upstream Synthesis Route
1003-09-4    108-30-5    52240-28-5 

[1]JournalofOrganicChemistry,2001,vol.66,#22,p.7283-7286

[2]OrganicSyntheses,2002,vol.79,p.204-204

[3]JournaloftheChemicalSociety,1954,p.4162,4165

[4]RecueildesTravauxChimiquesdesPays-Bas,1950,vol.69,p.1083,1103

[5]NipponKagakuZasshi,1957,vol.78,p.779,783

[6]Chem.Abstr.,1960,p.22559

1003-09-4    108-30-5    80885-88-7    52240-28-5 

[1]Patent:US4299769,1981,A,

1003-09-4    543-20-4    52240-28-5    1289489-53-7    1289489-58-2 

[1]ChemistryofHeterocyclicCompounds,2011,vol.46,#10,p.1199-1207

1003-09-4    543-20-4    52240-28-5    1289489-53-7 

[1]ChemistryofHeterocyclicCompounds,2011,vol.46,#10,p.1199-1207

1003-09-4    543-20-4    52240-28-5    144153-56-0    1289489-53-7 

[1]ChemistryofHeterocyclicCompounds,2011,vol.46,#10,p.1199-1207

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