4-(4-chlorophenyl)-1H-pyrazol-5-amine


Chemical Name: 4-(4-chlorophenyl)-1H-pyrazol-5-amine
CAS Number: 40545-65-1
Product Number: AG00CK0H(AGN-PC-0JN8W0)
Synonyms:
MDL No:
Molecular Formula: C9H8ClN3
Molecular Weight: 193.6329

Identification/Properties


Properties
MP:
141-143℃(Solv: isopropanol (67-63-0))
BP:
419 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
193.634g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
193.041g/mol
Monoisotopic Mass:
193.041g/mol
Topological Polar Surface Area:
54.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
168
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:
Danger
UN#:
2811
Hazard Statements:
H301-H318
Precautionary Statements:
P280-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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