1H-Pyrazole-4-carboxylic acid, 5-amino-1-(4-fluorophenyl)-


Chemical Name: 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(4-fluorophenyl)-
CAS Number: 187949-90-2
Product Number: AG002GL7(AGN-PC-0LOGL9)
Synonyms:
MDL No:
Molecular Formula: C10H8FN3O2
Molecular Weight: 221.1878

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
221.191g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
221.06g/mol
Monoisotopic Mass:
221.06g/mol
Topological Polar Surface Area:
81.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
269
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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