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1020042-77-6,MFCD21640309
Catalog No.:AA00067Y
1020042-77-6 | 8-Chloro-[1,2,4]triazolo[4,3-a]pyridin-3(2h)-one
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$258.00   $180.00
- +
1g
98%
in stock  
$762.00   $534.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA00067Y
Chemical Name:
8-Chloro-[1,2,4]triazolo[4,3-a]pyridin-3(2h)-one
CAS Number:
1020042-77-6
Molecular Formula:
C6H4ClN3O
Molecular Weight:
169.5685
MDL Number:
MFCD21640309
IUPAC Name:
8-chloro-2H-[1,2,4]triazolo[4,3-a]pyridin-3-one
InChI:
InChI=1S/C6H4ClN3O/c7-4-2-1-3-10-5(4)8-9-6(10)11/h1-3H,(H,9,11)
InChI Key:
OUFUWBXNPZHZMI-UHFFFAOYSA-N
SMILES:
Clc1cccn2c1n[nH]c2=O
Properties
Computed Properties
 
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.004g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.568g/mol
Monoisotopic Mass:
169.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

Synonyms
 
1020042-77-6 
8-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-ol 
RP23180 
CS-0084377 
1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 8-chloro- 
8-CHLORO-[1,2,4]TRIAZOLO[4,3-A]PYRIDIN-3(2H)-ONE 
SCHEMBL20775937 
MFCD21640309 
ZINC72264983 
AKOS006311041 
AKOS027425055 
MCULE-7564481479 
NE51765 
Literature
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