1H-Pyrazole, 1-phenyl-


Chemical Name: 1H-Pyrazole, 1-phenyl-
CAS Number: 1126-00-7
Product Number: AG003EMU(AGN-PC-03EAVT)
Synonyms:
MDL No:
Molecular Formula: C9H8N2
Molecular Weight: 144.1732

Identification/Properties


Properties
MP:
113 °C
BP:
141-142°C at 30 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.594-1.598
Computed Properties
Molecular Weight:
144.177g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
144.069g/mol
Monoisotopic Mass:
144.069g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
119
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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