Home Carboxys 1,3-dimethyl-5-(3-methyl-1H-pyrazol-1-yl)-1H-pyrazole-4-carboxylic acid

1,3-dimethyl-5-(3-methyl-1H-pyrazol-1-yl)-1H-pyrazole-4-carboxylic acid

CAS No.:
1251301-46-8
Catalog Number:
AG01AG4H
Molecular Formula:
C10H12N4O2
Molecular Weight:
220.2279
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Product Description
Catalog Number:
AG01AG4H
Chemical Name:
1,3-dimethyl-5-(3-methyl-1H-pyrazol-1-yl)-1H-pyrazole-4-carboxylic acid
CAS Number:
1251301-46-8
Molecular Formula:
C10H12N4O2
Molecular Weight:
220.2279
MDL Number:
MFCD16778542
IUPAC Name:
1,3-dimethyl-5-(3-methylpyrazol-1-yl)pyrazole-4-carboxylic acid
InChI:
InChI=1S/C10H12N4O2/c1-6-4-5-14(11-6)9-8(10(15)16)7(2)12-13(9)3/h4-5H,1-3H3,(H,15,16)
InChI Key:
KEYKCKOTIORUGP-UHFFFAOYSA-N
SMILES:
Cc1ccn(n1)c1n(C)nc(c1C(=O)O)C
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.096g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.232g/mol
Monoisotopic Mass:
220.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties