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Home Other Building Blocks 162848-16-0
162848-16-0,MFCD02682060
Catalog No.:AA001TEI

162848-16-0 | 4-(1H-1,2,4-Triazol-1-yl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$34.00   $24.00
- +
1g
95%
in stock  
$44.00   $31.00
- +
5g
95%
in stock  
$160.00   $112.00
- +
100g
98%
in stock  
$2,672.00   $1,870.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001TEI
Chemical Name:
4-(1H-1,2,4-Triazol-1-yl)benzoic acid
CAS Number:
162848-16-0
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
MDL Number:
MFCD02682060
SMILES:
OC(=O)c1ccc(cc1)n1ncnc1
Properties
Properties
 
BP:
424.1 °C at 760 mmHg  
Form:
Solid  
MP:
318 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
214  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.2  

Downstream Synthesis Route
1-p-tolyl-1.2.4-triazole 
  162848-16-0 

[1]GazzettaChimicaItaliana,1896,vol.26II,p.422

162848-16-0    203521-17-9   
1-(6-chloronaphthalene-2-sulfonyl)-4-4-(1,2,4-triazol-1-yl)benzoylpiperazine 

[1]Patent:US6359134,2002,B1.Locationinpatent:Example50

[1]Patent:US6359134,2002,B1.Locationinpatent:Referentialexample17

680569-68-0    162848-16-0   
N-(1S,2R)-2-((1S)-1-cyano-3-methylbutylamino}carbonyl)cyclohexyl-4-(1H-1,2,4-triazol-1-yl)benzamide 

[1]Patent:US2004/248949,2004,A1.Locationinpatent:Page42-43

[1]Patent:WO2004/111031,2004,A1.Locationinpatent:Page72

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:162848-16-0 Molecular Formula|162848-16-0 MDL|162848-16-0 SMILES|162848-16-0 4-(1H-1,2,4-Triazol-1-yl)benzoic acid