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Home Other Building Blocks 876715-40-1
876715-40-1,MFCD07643206
Catalog No.:AA004KEF

876715-40-1 | 4-(1H-1,2,4-Triazol-5-yl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$324.00   $227.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA004KEF
Chemical Name:
4-(1H-1,2,4-Triazol-5-yl)benzoic acid
CAS Number:
876715-40-1
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
MDL Number:
MFCD07643206
SMILES:
OC(=O)c1ccc(cc1)c1ncn[nH]1
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

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

Downstream Synthesis Route

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-WO2008/51494,2008,A1Locationinpatent:Page/Pagecolumn147-148

Literature
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Additional Info:
SDS
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Tags:876715-40-1 Molecular Formula|876715-40-1 MDL|876715-40-1 SMILES|876715-40-1 4-(1H-1,2,4-Triazol-5-yl)benzoic acid