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53458-16-5,MFCD00055470
Catalog No.:AA00DEB0

53458-16-5 | 4,4'-Difluorobenzoin

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%(GC)
in stock  
$294.00   $206.00
- +
250mg
98%(GC)
in stock  
$437.00   $306.00
- +
1g
98%(GC)
in stock  
$645.00   $452.00
- +
5g
98%(GC)
in stock  
$1,767.00   $1,237.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DEB0
Chemical Name:
4,4'-Difluorobenzoin
CAS Number:
53458-16-5
Molecular Formula:
C14H10F2O2
Molecular Weight:
248.2248
MDL Number:
MFCD00055470
SMILES:
Fc1ccc(cc1)C(=O)C(c1ccc(cc1)F)O
Properties
Properties
 
BP:
376°C at 760 mmHg  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
280  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.3  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1987,vol.30,p.1054-1068

[1]JournalofMedicinalChemistry,1992,vol.35,p.3498-3512

[1]BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1982,vol.31,p.340-341    IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1982,p.376-377

53458-16-5    366-68-7   
2,3,4,5-tetrakis(4-fluorophenyl)furan 

[1]SyntheticCommunications,1986,vol.16,p.377-386

[1]JournalofMedicinalChemistry,1993,vol.36,p.3658-3662

Literature

Title: Analysis of the inhibition of mammalian carboxylesterases by novel fluorobenzoins and fluorobenzils.

Journal: Bioorganic & medicinal chemistry 20070601

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SDS
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Tags:53458-16-5 Molecular Formula|53458-16-5 MDL|53458-16-5 SMILES|53458-16-5 4,4'-Difluorobenzoin
Catalog No.: AA00DEB0
53458-16-5,MFCD00055470
53458-16-5 | 4,4'-Difluorobenzoin
Pack Size： 100mg
Purity： 98%(GC)
in stock
$294.00 $206.00
Pack Size： 250mg
Purity： 98%(GC)
in stock
$437.00 $306.00
Pack Size： 1g
Purity： 98%(GC)
in stock
$645.00 $452.00
Pack Size： 5g
Purity： 98%(GC)
in stock
$1,767.00 $1,237.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DEB0
Chemical Name: 4,4'-Difluorobenzoin
CAS Number: 53458-16-5
Molecular Formula: C14H10F2O2
Molecular Weight: 248.2248
MDL Number: MFCD00055470
SMILES: Fc1ccc(cc1)C(=O)C(c1ccc(cc1)F)O
Properties
BP: 376°C at 760 mmHg  
Storage: Keep in dry area;Room Temperature;  
Complexity: 280  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.3  
Downstream Synthesis Route
50-00-0    53458-16-5    107680-41-1 

[1]JournalofMedicinalChemistry,1987,vol.30,p.1054-1068

53458-16-5    143546-85-4    143546-92-3 

[1]JournalofMedicinalChemistry,1992,vol.35,p.3498-3512

53458-16-5    458-76-4 

[1]BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1982,vol.31,p.340-341    IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1982,p.376-377

53458-16-5    366-68-7   
2,3,4,5-tetrakis(4-fluorophenyl)furan 

[1]SyntheticCommunications,1986,vol.16,p.377-386

366-68-7    53458-16-5 

[1]JournalofMedicinalChemistry,1993,vol.36,p.3658-3662

Literature fold

Title: Analysis of the inhibition of mammalian carboxylesterases by novel fluorobenzoins and fluorobenzils.

Journal: Bioorganic & medicinal chemistry20070601

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1822633-59-9
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54777-65-0
54777-65-0
1206908-23-7
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