1H-Pyrazole, 4-bromo-1-phenyl-


Chemical Name: 1H-Pyrazole, 4-bromo-1-phenyl-
CAS Number: 15115-52-3
Product Number: AG001N4T(AGN-PC-0O492Z)
Synonyms:
MDL No: MFCD00234505
Molecular Formula: C9H7BrN2
Molecular Weight: 223.0693

Identification/Properties


Properties
MP:
78-79℃
BP:
296.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
223.073g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
221.979g/mol
Monoisotopic Mass:
221.979g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
146
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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