1H-Pyrazole-4-carboxylic acid, 1-(4-chlorophenyl)-3,5-dimethyl-


Chemical Name: 1H-Pyrazole-4-carboxylic acid, 1-(4-chlorophenyl)-3,5-dimethyl-
CAS Number: 113808-87-0
Product Number: AG019VY5(AGN-PC-0M7UO4)
Synonyms:
MDL No:
Molecular Formula: C12H11ClN2O2
Molecular Weight: 250.6809

Identification/Properties


Computed Properties
Molecular Weight:
250.682g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
250.051g/mol
Monoisotopic Mass:
250.051g/mol
Topological Polar Surface Area:
55.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
292
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

Safety Information


NMR Spectrum


Other Analytical Data


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