Home Carboxys 3-methyl-[1,2,4triazolo[4,3-apyridine-6-carboxylic acid

3-methyl-[1,2,4triazolo[4,3-apyridine-6-carboxylic acid

CAS No.:
1427378-85-5
Catalog Number:
AG009YT1
Molecular Formula:
C8H8ClN3O2
Molecular Weight:
213.6210
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Product Description
Catalog Number:
AG009YT1
Chemical Name:
3-methyl-[1,2,4triazolo[4,3-apyridine-6-carboxylic acid
CAS Number:
1427378-85-5
Molecular Formula:
C8H8ClN3O2
Molecular Weight:
213.6210
MDL Number:
MFCD23144194
IUPAC Name:
3-methyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;hydrochloride
InChI:
InChI=1S/C8H7N3O2.ClH/c1-5-9-10-7-3-2-6(8(12)13)4-11(5)7;/h2-4H,1H3,(H,12,13);1H
InChI Key:
OFWIPSCBGNYCGV-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2n(c1)c(C)nn2.Cl
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.031g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.621g/mol
Monoisotopic Mass:
213.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties