4-Pyridazinecarboxylic acid, 3-methyl-, ethyl ester


Chemical Name: 4-Pyridazinecarboxylic acid, 3-methyl-, ethyl ester
CAS Number: 98832-80-5
Product Number: AG00IK6A(AGN-PC-00MJZN)
Synonyms:
MDL No:
Molecular Formula: C8H10N2O2
Molecular Weight: 166.1772

Identification/Properties


Computed Properties
Molecular Weight:
166.18g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
166.074g/mol
Monoisotopic Mass:
166.074g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
161
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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Chemical Structure



Ethyl 3-methylpyridazine-4-carboxylate is a versatile compound that finds wide application in chemical synthesis due to its unique structure and reactivity. This particular compound is often used as a key building block in the synthesis of various pharmaceuticals, agrochemicals, and advanced materials.One notable application of Ethyl 3-methylpyridazine-4-carboxylate is its use in the preparation of heterocyclic compounds, which are important structural motifs found in many biologically active molecules. By incorporating this compound into chemical reactions, chemists can access a diverse array of complex molecules with tailored properties and functionalities.Furthermore, Ethyl 3-methylpyridazine-4-carboxylate serves as a valuable intermediate in the synthesis of pyridazine derivatives, which have demonstrated promising biological activities such as antimicrobial, anticancer, and anti-inflammatory properties. Its ability to undergo various transformations makes it a valuable tool for designing and preparing novel compounds with potential therapeutic benefits.Overall, Ethyl 3-methylpyridazine-4-carboxylate plays a crucial role in modern chemical synthesis by enabling the efficient construction of complex molecules and facilitating the discovery of new compounds with diverse applications.