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


Chemical Name: 1H-Pyrazole-4-carboxaldehyde, 3-(4-fluorophenyl)-
CAS Number: 306936-57-2
Product Number: AG0030XK(AGN-PC-0O8RQJ)
Synonyms:
MDL No:
Molecular Formula: C10H7FN2O
Molecular Weight: 190.1738

Identification/Properties


Properties
MP:
160 °C
BP:
416°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Air Sensitive
Computed Properties
Molecular Weight:
190.177g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
190.054g/mol
Monoisotopic Mass:
190.054g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
204
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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