Ethanone, 1-[4-(1H-pyrazol-1-yl)phenyl]-


Chemical Name: Ethanone, 1-[4-(1H-pyrazol-1-yl)phenyl]-
CAS Number: 25699-98-3
Product Number: AG003KLE(AGN-PC-0NI748)
Synonyms:
MDL No:
Molecular Formula: C11H10N2O
Molecular Weight: 186.2099

Identification/Properties


Properties
MP:
108℃
BP:
323.453°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
186.214g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
186.079g/mol
Monoisotopic Mass:
186.079g/mol
Topological Polar Surface Area:
34.9A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
209
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:
H302-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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