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50907-19-2,MFCD00798373
Catalog No.:AA003M10

50907-19-2 | 5-(2-FLUOROPHENYL)-1H-1,2,3,4-TETRAAZOLE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$29.00   $20.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003M10
Chemical Name:
5-(2-FLUOROPHENYL)-1H-1,2,3,4-TETRAAZOLE
CAS Number:
50907-19-2
Molecular Formula:
C7H5FN4
Molecular Weight:
164.1398
MDL Number:
MFCD00798373
SMILES:
Fc1ccccc1c1nnn[nH]1
Properties
Properties
 
Form:
Solid  
MP:
>158°C (dec.)  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
154  
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:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.2  

Downstream Synthesis Route

[1]Aureggi,Valentina;Sedelmeier,Gottfried[AngewandteChemie-InternationalEdition,2007,vol.46,#44,p.8440-8444]

[2]Sharma,Swagat;Kozek,KrystianA.;Abney,KristopherK.;Kumar,Sushil;Gautam,Nagsen;Alnouti,Yazen;DavidWeaver;Hopkins,CoreyR.[BioorganicandMedicinalChemistryLetters,2019,vol.29,#6,p.791-796]

[3]Russel,RonaldK.;Murray,WilliamV.[JournalofOrganicChemistry,1993,vol.58,#18,p.5023-5024]

[4]Paudel,Suresh;Min,Xiao;Acharya,Srijan;Khadka,DaulatBikram;Yoon,Goo;Kim,Kyeong-Man;Cheon,SeungHoon[BioorganicandMedicinalChemistry,2017,vol.25,#20,p.5278-5289]

[5]Kantevari,Srinivas;Nair,C.K.Snehalatha;Pardhasaradhi[JournalofHeterocyclicChemistry,2006,vol.43,#5,p.1353-1356]

[6]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2005/14602,2005,A1Locationinpatent:Page/Pagecolumn44-45

Literature
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SDS
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Tags:50907-19-2 Molecular Formula|50907-19-2 MDL|50907-19-2 SMILES|50907-19-2 5-(2-FLUOROPHENYL)-1H-1,2,3,4-TETRAAZOLE
Catalog No.: AA003M10
50907-19-2,MFCD00798373
50907-19-2 | 5-(2-FLUOROPHENYL)-1H-1,2,3,4-TETRAAZOLE
Pack Size： 1g
Purity： 98%
in stock
$29.00 $20.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA003M10
Chemical Name: 5-(2-FLUOROPHENYL)-1H-1,2,3,4-TETRAAZOLE
CAS Number: 50907-19-2
Molecular Formula: C7H5FN4
Molecular Weight: 164.1398
MDL Number: MFCD00798373
SMILES: Fc1ccccc1c1nnn[nH]1
Properties
Form: Solid  
MP: >158°C (dec.)  
Storage: Room Temperature;  
Complexity: 154  
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: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.2  
Downstream Synthesis Route
394-47-8    50907-19-2 

[1]Aureggi,Valentina;Sedelmeier,Gottfried[AngewandteChemie-InternationalEdition,2007,vol.46,#44,p.8440-8444]

[2]Sharma,Swagat;Kozek,KrystianA.;Abney,KristopherK.;Kumar,Sushil;Gautam,Nagsen;Alnouti,Yazen;DavidWeaver;Hopkins,CoreyR.[BioorganicandMedicinalChemistryLetters,2019,vol.29,#6,p.791-796]

[3]Russel,RonaldK.;Murray,WilliamV.[JournalofOrganicChemistry,1993,vol.58,#18,p.5023-5024]

[4]Paudel,Suresh;Min,Xiao;Acharya,Srijan;Khadka,DaulatBikram;Yoon,Goo;Kim,Kyeong-Man;Cheon,SeungHoon[BioorganicandMedicinalChemistry,2017,vol.25,#20,p.5278-5289]

[5]Kantevari,Srinivas;Nair,C.K.Snehalatha;Pardhasaradhi[JournalofHeterocyclicChemistry,2006,vol.43,#5,p.1353-1356]

[6]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2005/14602,2005,A1Locationinpatent:Page/Pagecolumn44-45

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