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94-00-8,MFCD00059787
Catalog No.:AA00GVQ2

94-00-8 | Phenyl isonicotinate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25g
>98.0%(GC)(T)
in stock  
$231.00   $162.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00GVQ2
Chemical Name:
Phenyl isonicotinate
CAS Number:
94-00-8
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
MDL Number:
MFCD00059787
SMILES:
O=C(c1ccncc1)Oc1ccccc1
Properties
Computed Properties
 
Complexity:
206  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.5  

Downstream Synthesis Route

[1]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1953,vol.73,p.601,604    Chem.Abstr.,1954,p.9363

[1]ChemistryLetters,1990,p.267-268

[2]BulletinoftheChemicalSocietyofJapan,1998,vol.71,p.1125-1135

[1]BenHalima,Taoufik;Vandavasi,JayaKishore;Shkoor,Mohanad;Newman,StephenG.[ACSCatalysis,2017,vol.7,#3,p.2176-2180]

Literature
Quotation Request
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SDS
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Tags:94-00-8 Molecular Formula|94-00-8 MDL|94-00-8 SMILES|94-00-8 Phenyl isonicotinate
Catalog No.: AA00GVQ2
94-00-8,MFCD00059787
94-00-8 | Phenyl isonicotinate
Pack Size： 25g
Purity： >98.0%(GC)(T)
in stock
$231.00 $162.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00GVQ2
Chemical Name: Phenyl isonicotinate
CAS Number: 94-00-8
Molecular Formula: C12H9NO2
Molecular Weight: 199.2054
MDL Number: MFCD00059787
SMILES: O=C(c1ccncc1)Oc1ccccc1
Properties
Complexity: 206  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.5  
Downstream Synthesis Route
7504-94-1    94-00-8    99057-43-9 

[1]YakugakuZasshi/JournalofthePharmaceuticalSocietyofJapan,1953,vol.73,p.601,604    Chem.Abstr.,1954,p.9363

34117-90-3    94-00-8    127376-27-6 

[1]ChemistryLetters,1990,p.267-268

[2]BulletinoftheChemicalSocietyofJapan,1998,vol.71,p.1125-1135

504-29-0    94-00-8    59898-94-1 

[1]BenHalima,Taoufik;Vandavasi,JayaKishore;Shkoor,Mohanad;Newman,StephenG.[ACSCatalysis,2017,vol.7,#3,p.2176-2180]

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