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Home Carboxes 28711-29-7
28711-29-7,MFCD00036051
Catalog No.:AA002W4B

28711-29-7 | 1,2,4-Triazole-1-acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$16.00   $11.00
- +
1g
98%
in stock  
$62.00   $44.00
- +
5g
98%
in stock  
$170.00   $119.00
- +
10g
98%
in stock  
$278.00   $195.00
- +
25g
98%
in stock  
$544.00   $381.00
- +
100g
98%
in stock  
$1,640.00   $1,148.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002W4B
Chemical Name:
1,2,4-Triazole-1-acetic acid
CAS Number:
28711-29-7
Molecular Formula:
C4H5N3O2
Molecular Weight:
127.1014
MDL Number:
MFCD00036051
SMILES:
OC(=O)Cn1cncn1
Properties
Properties
 
BP:
376.9°C at 760 mmHg  
Form:
Solid  
MP:
>200°C (dec.)  
Storage:
Inert atmosphere;-20 ℃;  

Computed Properties
 
Complexity:
116  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
-0.3  

Downstream Synthesis Route

[1]Nagao,Yoshimitsu;Sano,Shigeki;Oxhiai,Masahito;Fujita,Eichi[Tetrahedron,1990,vol.46,#9,p.3211-3232]

[2]CurrentPatentAssignee:ORIONOYJ-WO2013/53983,2013,A1Locationinpatent:Page/Pagecolumn39

[3]CurrentPatentAssignee:ORIONOYJ-US2015/11548,2015,A1Locationinpatent:Paragraph0159

[4]Ainsworth;Jones[JournaloftheAmericanChemicalSociety,1955,vol.77,p.621,623]

[1]Micetich,R.G.etal.[JournalofMedicinalChemistry,1972,vol.15,p.333-335]

28711-29-7   
C4H4(2)HN3O2 
 
C4H3(2)H2N3O2 

[1]Nagao,Yoshimitsu;Sano,Shigeki;Oxhiai,Masahito;Fujita,Eichi[Tetrahedron,1990,vol.46,#9,p.3211-3232]

28711-29-7   
(1-hydroxy-1-phosphono-2-1,2,4triazol-1-yl-ethyl)-phosphonicacid 

[1]Widler,Leo;Jaeggi,KnutA.;Glatt,Markus;Müller,Klaus;Bachmann,Rolf;Bisping,Michael;Born,Anne-Ruth;Cortesi,Reto;Guiglia,Gabriela;Jeker,Heidi;Klein,Rémy;Ramseier,Ueli;Schmid,Johann;Schreiber,Gerard;Seltenmeyer,Yves;Green,JonathanR.[JournalofMedicinalChemistry,2002,vol.45,#17,p.3721-3738]

Literature
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SDS
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Tags:28711-29-7 Molecular Formula|28711-29-7 MDL|28711-29-7 SMILES|28711-29-7 1,2,4-Triazole-1-acetic acid