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


Chemical Name: 1H-Pyrazole-4-carboxylic acid, 1-(4-fluorophenyl)-3,5-dimethyl-
CAS Number: 288251-63-8
Product Number: AG00BH04(AGN-PC-0K5ZV6)
Synonyms:
MDL No:
Molecular Formula: C12H11FN2O2
Molecular Weight: 234.2263

Identification/Properties


Computed Properties
Molecular Weight:
234.23g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
234.08g/mol
Monoisotopic Mass:
234.08g/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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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