Home Carboxys 1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazole-4-carboxylic acid

1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazole-4-carboxylic acid

CAS No.:
1249019-47-3
Catalog Number:
AG01AG1V
Molecular Formula:
C9H10N4O2
Molecular Weight:
206.2013
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Product Description
Catalog Number:
AG01AG1V
Chemical Name:
1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazole-4-carboxylic acid
CAS Number:
1249019-47-3
Molecular Formula:
C9H10N4O2
Molecular Weight:
206.2013
MDL Number:
MFCD16109147
IUPAC Name:
1-methyl-3-(1-methylpyrazol-4-yl)pyrazole-4-carboxylic acid
InChI:
InChI=1S/C9H10N4O2/c1-12-4-6(3-10-12)8-7(9(14)15)5-13(2)11-8/h3-5H,1-2H3,(H,14,15)
InChI Key:
QBOYJJFSHNEBIS-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1)c1nn(cc1C(=O)O)C
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.08g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.205g/mol
Monoisotopic Mass:
206.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties