1H-Pyrazole-4-carboxaldehyde, 1-(4-fluorophenyl)-3-phenyl-


Chemical Name: 1H-Pyrazole-4-carboxaldehyde, 1-(4-fluorophenyl)-3-phenyl-
CAS Number: 36640-47-8
Product Number: AG00CIJW(AGN-PC-0L0B14)
Synonyms:
MDL No:
Molecular Formula: C16H11FN2O
Molecular Weight: 266.2697432

Identification/Properties


Computed Properties
Molecular Weight:
266.275g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
266.086g/mol
Monoisotopic Mass:
266.086g/mol
Topological Polar Surface Area:
34.9A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
324
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

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NMR Spectrum


Other Analytical Data


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