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Home Aldehydes 136689-94-6
136689-94-6,MFCD08669914
Catalog No.:AA00124V

136689-94-6 | 3-(2H-Tetrazol-5-yl)benzaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$222.00   $155.00
- +
1g
95%
in stock  
$481.00   $337.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00124V
Chemical Name:
3-(2H-Tetrazol-5-yl)benzaldehyde
CAS Number:
136689-94-6
Molecular Formula:
C8H6N4O
Molecular Weight:
174.1594
MDL Number:
MFCD08669914
SMILES:
O=Cc1cccc(c1)c1n[nH]nn1
Properties
Properties
 
Form:
Solid  
MP:
196-198℃  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
187  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.6  

Downstream Synthesis Route

[1]Khadtare,Nikhil;Stephani,Ralph;Korlipara,Vijaya[BioorganicandMedicinalChemistryLetters,2017,vol.27,#11,p.2281-2285]

[2]Erken,Esma;Esirden,Ibrahim;Kaya,Muharrem;Sen,Fatih[RSCAdvances,2015,vol.5,#84,p.68558-68564]

[3]Esirden,Ibrahim;Erken,Esma;Kaya,Muharrem;Sen,Fatih[Catalysisscienceandtechnology,2015,vol.5,#9,p.4452-4457]

[4]Baskaya,Gaye;Esirden,Ibrahim;Erken,Esma;Sen,Fatih;Kaya,Muharrem[JournalofNanoscienceandNanotechnology,2017,vol.17,#3,p.1992-1999]

[5]Esirden,Ibrahim;Başar,Erhan;Kaya,Muharrem[ChemicalPapers,2015,vol.69,#9,p.1231-1236]

[6]Esirden,İbrahim;Tanç,Muhammet;Supuran,ClaudiuT.;Kaya,Muharrem[BioorganicandMedicinalChemistryLetters,2017,vol.27,#1,p.86-89]

[7]Hansen,StinneW.;Erichsen,MetteN.;Fu,Bingru;Bjørn-Yoshimoto,WaldenE.;Abrahamsen,Bjarke;Hansen,JacobC.;Jensen,AndersA.;Bunch,Lennart[JournalofMedicinalChemistry,2016,vol.59,#19,p.8757-8770]

[8]LakshmiKantam;Balasubrahmanyam;ShivaKumar[SyntheticCommunications,2006,vol.36,#12,p.1809-1814]

[9]Jütten,Peter;Schumann,Winfried;Härtl,Albert;Dahse,Hans-Martin;Gräfe,Udo[JournalofMedicinalChemistry,2007,vol.50,#15,p.3661-3666]

[10]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-US6251911,2001,B1

[1]JournalofMedicinalChemistry,1998,vol.41,p.2390-2410

30879-49-3    136689-94-6   
(E)-3-(3-(1H-tetrazol-5-yl)phenyl)-1-(5-hydroxy-2-nitrophenyl)prop-2-en-1-one 

[1]Khadtare,Nikhil;Stephani,Ralph;Korlipara,Vijaya[BioorganicandMedicinalChemistryLetters,2017,vol.27,#11,p.2281-2285]

Literature
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SDS
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