1H-Pyrazol-4-ol, 3,5-dimethyl-


Chemical Name: 1H-Pyrazol-4-ol, 3,5-dimethyl-
CAS Number: 2820-38-4
Product Number: AG007L2Q(AGN-PC-0KXDSV)
Synonyms:
MDL No:
Molecular Formula: C5H8N2O
Molecular Weight: 112.1298

Identification/Properties


Computed Properties
Molecular Weight:
112.132g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
112.064g/mol
Monoisotopic Mass:
112.064g/mol
Topological Polar Surface Area:
48.9A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
86.5
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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Chemical Structure



3,5-Dimethyl-1H-pyrazol-4-ol is a versatile compound widely used in chemical synthesis as a key building block. This compound serves as an important precursor in the production of various pharmaceuticals, agrochemicals, and specialty chemicals. Its unique structure and reactivity make it valuable in the synthesis of complex organic molecules.One significant application of 3,5-Dimethyl-1H-pyrazol-4-ol is in the synthesis of novel heterocyclic compounds. By incorporating this compound into organic reactions, chemists can access a diverse array of heterocyclic scaffolds with potential biological activities. Additionally, its presence in the synthesis of pharmaceutical intermediates highlights its crucial role in drug discovery and development processes.Furthermore, 3,5-Dimethyl-1H-pyrazol-4-ol is utilized in the preparation of functional materials such as dyes, polymers, and metal-organic frameworks. Its ability to participate in various synthetic transformations enables the creation of tailor-made materials with specific properties and applications.Overall, the application of 3,5-Dimethyl-1H-pyrazol-4-ol in chemical synthesis demonstrates its significance in advancing the field of organic chemistry and enabling the creation of diverse and complex molecules with potential industrial and pharmaceutical applications.