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Home Fluorides 80240-40-0
80240-40-0,MFCD11053874
Catalog No.:AA005C6W

80240-40-0 | 4-(4-Fluorophenyl)-1H-1,2,4-triazol-5(4H)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98
in stock  
$93.00   $65.00
- +
5g
98%
in stock  
$311.00   $218.00
- +
25g
98%
in stock  
$809.00   $567.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005C6W
Chemical Name:
4-(4-Fluorophenyl)-1H-1,2,4-triazol-5(4H)-one
CAS Number:
80240-40-0
Molecular Formula:
C8H6FN3O
Molecular Weight:
179.1511
MDL Number:
MFCD11053874
SMILES:
Fc1ccc(cc1)n1cn[nH]c1=O
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
236  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1  

Downstream Synthesis Route

[1]Kitazaki,Tomoyuki;Tamura,Norikazu;Tasaka,Akihiro;Matsushita,Yoshihiro;Hayashi,Ryogo;Okonogi,Kenji;Itoh,Katsumi[ChemicalandPharmaceuticalBulletin,1996,vol.44,#2,p.314-327]

[2]Locationinpatent:experimentalpartSheng,Chunquan;Che,Xiaoying;Wang,Wenya;Wang,Shengzheng;Cao,Yongbing;Miao,Zhenyuan;Yao,Jianzhong;Zhang,Wannian[EuropeanJournalofMedicinalChemistry,2011,vol.46,#11,p.5276-5282]

80240-40-0   
Trifluoro-methanesulfonicacid(S)-1-(R)-2-(2,4-difluoro-phenyl)-oxiranyl-ethylester 
  155431-23-5 

[1]Kitazaki,Tomoyuki;Tamura,Norikazu;Tasaka,Akihiro;Matsushita,Yoshihiro;Hayashi,Ryogo;Okonogi,Kenji;Itoh,Katsumi[ChemicalandPharmaceuticalBulletin,1996,vol.44,#2,p.314-327]

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-US5371101,1994,A

[1]Locationinpatent:experimentalpartJiang,Yongwei;Cao,Yongbin;Zhang,Jun;Zou,Yan;Chai,Xiaoyun;Hu,Honggang;Zhao,Qingjie;Wu,Qiuye;Zhang,Dazhi;Jiang,Yuanying;Sun,Qingyan[EuropeanJournalofMedicinalChemistry,2011,vol.46,#7,p.3135-3141]

80240-40-0   
1-2-(2,4-difluorophenyl)-2,3-epoxypropyl-1H-1,2,4-triazolemethanesulfonate 
  1312809-81-6 

[1]Locationinpatent:experimentalpartJiang,Yongwei;Cao,Yongbin;Zhang,Jun;Zou,Yan;Chai,Xiaoyun;Hu,Honggang;Zhao,Qingjie;Wu,Qiuye;Zhang,Dazhi;Jiang,Yuanying;Sun,Qingyan[EuropeanJournalofMedicinalChemistry,2011,vol.46,#7,p.3135-3141]

Literature
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SDS
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Tags:80240-40-0 Molecular Formula|80240-40-0 MDL|80240-40-0 SMILES|80240-40-0 4-(4-Fluorophenyl)-1H-1,2,4-triazol-5(4H)-one