1H-Pyrazole-4-carboxylic acid, 1,5-diphenyl-


Chemical Name: 1H-Pyrazole-4-carboxylic acid, 1,5-diphenyl-
CAS Number: 98700-53-9
Product Number: AG006R3E(AGN-PC-0L09D1)
Synonyms:
MDL No:
Molecular Formula: C16H12N2O2
Molecular Weight: 264.2787

Identification/Properties


Properties
BP:
451.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
264.284g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
264.09g/mol
Monoisotopic Mass:
264.09g/mol
Topological Polar Surface Area:
55.1A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
335
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:
H302-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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