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Home Amines 502685-67-8
502685-67-8,MFCD05182371
Catalog No.:AA00DCZ7

502685-67-8 | 5-(3-fluorophenyl)-4H-1,2,4-triazol-3-amine

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1g
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$324.00   $227.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DCZ7
Chemical Name:
5-(3-fluorophenyl)-4H-1,2,4-triazol-3-amine
CAS Number:
502685-67-8
Molecular Formula:
C8H7FN4
Molecular Weight:
178.1664
MDL Number:
MFCD05182371
SMILES:
Fc1cccc(c1)c1nnc([nH]1)N
Properties
Computed Properties
 
Complexity:
178  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1.4  

Downstream Synthesis Route

[1]Dolzhenko,AntonV.;Kalinina,SvetlanaA.;Kalinin,DmitriiV.[RSCAdvances,2013,vol.3,#36,p.15850-15855]

[1]Bera,Hriday;Tan,BeeJen;Sun,Lingyi;Dolzhenko,AntonV.;Chui,Wai-Keung;Chiu,GigiNagarChee[EuropeanJournalofMedicinalChemistry,2013,vol.67,p.325-334]

502685-67-8   
ethoxycarbonylisothiocyanate 
  1456614-05-3 

[1]Bera,Hriday;Tan,BeeJen;Sun,Lingyi;Dolzhenko,AntonV.;Chui,Wai-Keung;Chiu,GigiNagarChee[EuropeanJournalofMedicinalChemistry,2013,vol.67,p.325-334]

[1]Bera,Hriday;Tan,BeeJen;Sun,Lingyi;Dolzhenko,AntonV.;Chui,Wai-Keung;Chiu,GigiNagarChee[EuropeanJournalofMedicinalChemistry,2013,vol.67,p.325-334]

[1]Bera,Hriday;Tan,BeeJen;Sun,Lingyi;Dolzhenko,AntonV.;Chui,Wai-Keung;Chiu,GigiNagarChee[EuropeanJournalofMedicinalChemistry,2013,vol.67,p.325-334]

Literature
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SDS
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Tags:502685-67-8 Molecular Formula|502685-67-8 MDL|502685-67-8 SMILES|502685-67-8 5-(3-fluorophenyl)-4H-1,2,4-triazol-3-amine