3-Butyn-1-ol, 4-(4-pyridinyl)-


Chemical Name: 3-Butyn-1-ol, 4-(4-pyridinyl)-
CAS Number: 192643-83-7
Product Number: AG002G68(AGN-PC-0NI0IB)
Synonyms:
MDL No: MFCD18384538
Molecular Formula: C9H9NO
Molecular Weight: 147.1739

Identification/Properties


Computed Properties
Molecular Weight:
147.177g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
147.068g/mol
Monoisotopic Mass:
147.068g/mol
Topological Polar Surface Area:
33.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
159
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

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Chemical Structure



4-(Pyridin-4-yl)but-3-yn-1-ol is a versatile chemical compound commonly used in organic synthesis. It serves as a valuable building block for the preparation of various functionalized compounds due to its unique structure and reactivity.This compound can be utilized as a key intermediate in the synthesis of heterocyclic compounds, particularly pyridine derivatives. Its alkyne functionality allows for further modification through various chemical reactions, such as Sonogashira coupling, click chemistry, and nucleophilic addition. These reactions enable the introduction of different functional groups at the alkyne position, expanding the chemical diversity and potential applications of the final products.Additionally, 4-(Pyridin-4-yl)but-3-yn-1-ol can participate in cascade reactions to access complex molecular architectures efficiently. Its presence in multicomponent reactions can lead to the formation of structurally diverse compounds in a single synthetic step, making it a valuable tool for the rapid assembly of molecular libraries for drug discovery and materials science applications.Overall, the strategic incorporation of 4-(Pyridin-4-yl)but-3-yn-1-ol in chemical synthesis provides chemists with a powerful means to access novel compounds with tailored properties and functionalities for a wide range of applications in the field of organic chemistry.