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519059-09-7,MFCD03094342
Catalog No.:AA00DG4T

519059-09-7 | 3-Cyano-4-fluorobenzyl cyanide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$16.00   $11.00
- +
250mg
95%
in stock  
$27.00   $19.00
- +
1g
95%
in stock  
$62.00   $43.00
- +
5g
95%
in stock  
$265.00   $186.00
- +
10g
95%
in stock  
$490.00   $343.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DG4T
Chemical Name:
3-Cyano-4-fluorobenzyl cyanide
CAS Number:
519059-09-7
Molecular Formula:
C9H5FN2
Molecular Weight:
160.1478
MDL Number:
MFCD03094342
SMILES:
N#CCc1ccc(c(c1)C#N)F
Properties
Properties
 
BP:
302°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
244  
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:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.4  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,#3,p.1100-1105

Downstream Synthesis Route

[1]Patent:US2009/176765,2009,A1

[2]Patent:US2009/176765,2009,A1.Locationinpatent:Page/Pagecolumn31

[1]Patent:WO2009/63244,2009,A1.Locationinpatent:Page/Pagecolumn76

[2]Patent:US2009/176765,2009,A1.Locationinpatent:Page/Pagecolumn29

[1]Patent:WO2009/63244,2009,A1.Locationinpatent:Page/Pagecolumn79

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.1100-1105

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.1100-1105

Literature
Quotation Request
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SDS
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Tags:519059-09-7 Molecular Formula|519059-09-7 MDL|519059-09-7 SMILES|519059-09-7 3-Cyano-4-fluorobenzyl cyanide
Catalog No.: AA00DG4T
519059-09-7,MFCD03094342
519059-09-7 | 3-Cyano-4-fluorobenzyl cyanide
Pack Size： 100mg
Purity： 95%
in stock
$16.00 $11.00
Pack Size： 250mg
Purity： 95%
in stock
$27.00 $19.00
Pack Size： 1g
Purity： 95%
in stock
$62.00 $43.00
Pack Size： 5g
Purity： 95%
in stock
$265.00 $186.00
Pack Size： 10g
Purity： 95%
in stock
$490.00 $343.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DG4T
Chemical Name: 3-Cyano-4-fluorobenzyl cyanide
CAS Number: 519059-09-7
Molecular Formula: C9H5FN2
Molecular Weight: 160.1478
MDL Number: MFCD03094342
SMILES: N#CCc1ccc(c(c1)C#N)F
Properties
BP: 302°C at 760 mmHg  
Form: Solid  
Storage: Keep in dry area;Room Temperature;  
Complexity: 244  
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: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.4  
Upstream Synthesis Route
7677-24-9    180302-35-6    519059-09-7 

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,#3,p.1100-1105

Downstream Synthesis Route
107228-51-3    519059-09-7    959841-54-4 

[1]Patent:US2009/176765,2009,A1

[2]Patent:US2009/176765,2009,A1.Locationinpatent:Page/Pagecolumn31

107228-54-6    519059-09-7    959841-42-0    959841-41-9 

[1]Patent:WO2009/63244,2009,A1.Locationinpatent:Page/Pagecolumn76

[2]Patent:US2009/176765,2009,A1.Locationinpatent:Page/Pagecolumn29

519059-09-7    1057672-68-0    1154868-56-0    1154868-55-9 

[1]Patent:WO2009/63244,2009,A1.Locationinpatent:Page/Pagecolumn79

34584-69-5    519059-09-7    959841-61-3 

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.1100-1105

7677-24-9    180302-35-6    519059-09-7 

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.1100-1105

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