ethyl 3,5-dimethyl-1-(3-nitrophenyl)pyrazole-4-carboxylate


Chemical Name: ethyl 3,5-dimethyl-1-(3-nitrophenyl)pyrazole-4-carboxylate
CAS Number: 346440-86-6
Product Number: AG007D61(AGN-PC-0JUH17)
Synonyms:
MDL No: MFCD09037551
Molecular Formula: C14H15N3O4
Molecular Weight: 289.2866

Identification/Properties


Computed Properties
Molecular Weight:
289.291g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
289.106g/mol
Monoisotopic Mass:
289.106g/mol
Topological Polar Surface Area:
89.9A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
398
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


NMR Spectrum


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