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6498-04-0,MFCD08751333
Catalog No.:AA00EADK

6498-04-0 | 1,2,4-Triazine-3-carboxylic acid

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Purity
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Price(USD)
Quantity
  
1g
1 week  
$2,036.00   $1,425.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EADK
Chemical Name:
1,2,4-Triazine-3-carboxylic acid
CAS Number:
6498-04-0
Molecular Formula:
C4H2N3NaO2
Molecular Weight:
147.0674
MDL Number:
MFCD08751333
SMILES:
[O-]C(=O)c1nccnn1.[Na+]
Properties
Properties
 
BP:
402.6 °C at 760 mmHg  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
116  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
-0.9  

Downstream Synthesis Route

[1]Peewasan,Krisana;Wagenknecht,Hans-Achim[ChemBioChem,2017,vol.18,#15,p.1473-1476]

[2]Palmer,AndreasMarc;Grobbel,Burkhard;Brehm,Christof;Zimmermann,PeterJan;Buhr,Wilm;Feth,MartinPhilipp;Holst,HansChristof;Simon,WolfgangAlexander[BioorganicandMedicinalChemistry,2007,vol.15,#24,p.7647-7660]

Literature
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Additional Info:
SDS
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Tags:6498-04-0 Molecular Formula|6498-04-0 MDL|6498-04-0 SMILES|6498-04-0 1,2,4-Triazine-3-carboxylic acid