[1,2,4]Triazolo[4,3-a]pyridine-8-carboxylic acid


Chemical Name: [1,2,4]Triazolo[4,3-a]pyridine-8-carboxylic acid
CAS Number: 1216218-95-9
Product Number: AG0015EY(AGN-PC-0WB7OK)
Synonyms:
MDL No:
Molecular Formula: C7H5N3O2
Molecular Weight: 163.1335

Identification/Properties


Computed Properties
Molecular Weight:
163.136g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
163.038g/mol
Monoisotopic Mass:
163.038g/mol
Topological Polar Surface Area:
67.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
197
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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