ethyl 5-amino-1-(3-bromophenyl)-4-cyanopyrazole-3-carboxylate


Chemical Name: ethyl 5-amino-1-(3-bromophenyl)-4-cyanopyrazole-3-carboxylate
CAS Number: 1150163-94-2
Product Number: AG000FO2(AGN-PC-07XU68)
Synonyms:
MDL No:
Molecular Formula: C13H11BrN4O2
Molecular Weight: 335.1560

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
335.161g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
334.007g/mol
Monoisotopic Mass:
334.007g/mol
Topological Polar Surface Area:
93.9A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
410
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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