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Home Other Building Blocks 73096-39-6
73096-39-6,MFCD11847683
Catalog No.:AA003HWP

73096-39-6 | 3-(1H-Tetrazol-5-yl)benzoic Acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$66.00   $47.00
- +
1g
97%
in stock  
$127.00   $89.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003HWP
Chemical Name:
3-(1H-Tetrazol-5-yl)benzoic Acid
CAS Number:
73096-39-6
Molecular Formula:
C8H6N4O2
Molecular Weight:
190.1588
MDL Number:
MFCD11847683
SMILES:
OC(=O)c1cccc(c1)c1nnn[nH]1
NSC Number:
338094
Properties
Properties
 
BP:
496.4°C at 760 mmHg  
Form:
Solid  
MP:
>264°C (dec.)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
223  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
0.7  

Downstream Synthesis Route
73096-39-6   
meta-carboxy-5-phenyltetrazoleanion 

[1]Janic,I.;Kakas,M.[JournalofMolecularStructure,1986,vol.142,p.189-192]

73096-39-6   
meta-carboxy-5-phenyltetrazolecation 

[1]Janic,I.;Kakas,M.[JournalofMolecularStructure,1986,vol.142,p.189-192]

meta-carboxy-5-phenyltetrazoleanion 
  73096-39-6 

[1]Janic,I.;Kakas,M.[JournalofMolecularStructure,1986,vol.142,p.189-192]

meta-carboxy-5-phenyltetrazolecation 
  73096-39-6 

[1]Janic,I.;Kakas,M.[JournalofMolecularStructure,1986,vol.142,p.189-192]

Literature

Title: Tuning the framework topologies of Co(II)-doped Zn(II)-tetrazole-benzoate coordination polymers by ligand modifications: structures and spectral studies.

Journal: Inorganic chemistry 20090420

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SDS
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