CAS 14235-81-5 4-Aminophenylacetylene - Materials / Alfa Chemistry

NAVIGATION

4-Aminophenylacetylene

PRICE INQUIRY

Catalog Number

ACM14235815-1

CAS Number

14235-81-5

Product Name

4-Aminophenylacetylene

Structure

Category

Liquid Crystal (LC) Materials

IUPAC Name

4-ethynylaniline

Molecular Weight

117.15g/mol

Molecular Formula

C8H7N

Canonical SMILES

C#CC1=CC=C(C=C1)N

InChI

InChI=1S/C8H7N/c1-2-7-3-5-8(9)6-4-7/h1,3-6H,9H2

InChI Key

JXYITCJMBRETQX-UHFFFAOYSA-N

Application

4-Aminophenylacetylene is a versatile chemical compound primarily used in the synthesis of complex chemical structures, such as N-methyliminodiethyl 4-(4-ethynylphenyliminomethyl)benzeneboronate, and can also serve as a precursor for creating acetylene ligands like HC2-NDI, where NDI stands for 1,4,5,8-naphthalenediimide. It is a modified aniline characterized as a terminal alkyne, which can be synthesized via various methods, including using 2-methyl-3-butyn-2-ol (MEBYNOL). This compound is also an essential component in click chemistry reactions and has been studied for its ability to undergo transition metal-catalyzed polymerization to form poly(4-ethynylaniline). Furthermore, 4-aminophenylacetylene is used for the surface functionalization of materials such as multi-walled carbon nanotubes (MWNTs) and graphene, positively impacting their thermal behaviors and expanding their application potential.

Complexity

123

Covalently-Bonded Unit Count

Exact Mass

117.057849g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

117.057849g/mol

Rotatable Bond Count

XLogP3

1.3