1H-Pyrazole-4-carboxylic acid, 5-amino-1-phenyl-


Chemical Name: 1H-Pyrazole-4-carboxylic acid, 5-amino-1-phenyl-
CAS Number: 51649-80-0
Product Number: AG003MCT(AGN-PC-0JVTW8)
Synonyms:
MDL No:
Molecular Formula: C10H9N3O2
Molecular Weight: 203.1974

Identification/Properties


Properties
MP:
183-188 °C (dec.)(lit.)
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
203.201g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
203.069g/mol
Monoisotopic Mass:
203.069g/mol
Topological Polar Surface Area:
81.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
241
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#:
-
Hazard Statements:
H317
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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