61266-32-8

Basic information

• Product Name: 3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL
• Synonyms: AKOS PRN-0005;3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL;3-(4-Nitrophenyl)-2-propyn-1-ol
• CAS NO: 61266-32-8
• Molecular Formula: C₉H₇NO₃
• Molecular Weight: 177.16
• Mol File: 61266-32-8.mol
• Article Data: 76

Chemical Properties

• Boiling Point: 339.9 °C at 760 mmHg
• Flash Point: 152.4 °C
• Appearance: /
• Density: 1.34 g/cm³
• Vapor Pressure: 3.45E-05mmHg at 25°C
• Refractive Index: 1.616
• CAS DataBase Reference: 3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL(61266-32-8)
• EPA Substance Registry System: 3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL(61266-32-8)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 61266-32-8(Hazardous Substances Data)

Usage

General Description

3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL is a chemical compound with the molecular formula C9H7NO3. It is a yellow crystalline solid with a molecular weight of 177.16 g/mol. 3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL is an alcohol derivative and contains a nitro group and an alkyne group in its structure. It is commonly used in organic synthesis and pharmaceutical research as a building block for the preparation of various drugs and biologically active molecules. Additionally, it has potential applications in the field of materials science and as a reagent in chemical reactions. Due to its chemical properties, 3-(4-NITRO-PHENYL)-PROP-2-YN-1-OL is handled and stored with caution, as it may pose risks to human health and the environment.

InChI:InChI=1/C9H7NO3/c11-7-1-2-8-3-5-9(6-4-8)10(12)13/h3-6,11H,7H2

Upstream product

• 636-98-6 p-nitrobenzene iodide 
• 627-09-8 Propargyl acetate 
• 107-19-7 propargyl alcohol 
• 586-78-7 para-nitrophenyl bromide 
• 61266-31-7 2-((3-(4-nitrophenyl)prop-2-yn-1-yl)oxy)tetrahydro-2H-pyran 
• 5582-62-7 1-trimethylsilyloxy-2-propyne 
• 107-18-6 allyl alcohol 

Downstream Products

• 35271-56-8 3-(4-nitrophenyl)propyl-2-en-1-ol 
• 937-31-5 (4-Nitrophenyl)acetylene 
• 1235983-71-7 diisopropyl 1-(3-(4-nitrophenyl)-2-propyn-1-yl)hydrazine-1,2-dicarboxylate 
• 1268381-64-1 1-nitro-4-(3-(3-phenylprop-2-ynylsulfonyl)prop-1-ynyl)benzene 
• 1268381-67-4 (3-(4-methoxyphenyl)prop-2-ynyl)(3-(4-nitrophenyl)prop-2-ynyl)sulfane 
• 1268381-72-1 C₁₁H₉NO₃S 
• 1268381-62-9 1-methoxy-4-(3-(3-(4-nitrophenyl)prop-2-ynylsulfonyl)prop-1-ynyl)benzene 
• 1268381-76-5 6-methoxy-4-(4-nitro-phenyl)-1,3-dihydro-naphtho[2,3-c]thiophene 2,2-dioxide 
• 1268381-68-5 (3-(4-nitrophenyl)prop-2-ynyl)(3-p-tolylprop-2-ynyl)sulfane 
• 1268381-63-0 1-methyl-4-(3-(3-(4-nitrophenyl)prop-2-ynylsulfonyl)prop-1-ynyl)benzene 
• 1268381-69-6 (3-(4-nitrophenyl)prop-2-ynyl)(3-phenylprop-2-ynyl)sulfane 
• 1254485-98-7 4-benzoyl-3-(4-nitrophenyl)-5-phenylfuran-2-carbaldehyde 
• 1254485-95-4 ethyl 5-formyl-4-(4-nitrophenyl)-2-phenylfuran-3-carboxylate 
• 1402043-99-5 C₁₉H₁₃NO₃ 

Relevant articles and documents

Heptalene Synthesis by Addition of Aryl Acetylenes to Azulenes

Abstract: Aryl acetylenes bearing electron-withdrawing groups have been found that canadd to azulenes and yield 1,2-substituted heptalenes. Theoretical studies of thereaction mechanism helped to design the candidate molecules that have then beentested in

Rip It off: Nitro to Nitroso Reduction by Iron Half-Sandwich Complexes

Activation of [FeCl(dppe)Cp] (1) by chloride abstraction with Na[BArX4] (X = F, [B(3,5-(CF3)2-C6H3)4]; X = Cl, [B(3,5-Cl2-C6H3)4]) permits reactions with a range of nitro aromatics, RC6H4NO2 (R = halogen, Me, OMe, NO2 or NMe2), to give the cationic iron nitroso complexes [Fe{N(O)-C6H4R}(dppe)Cp][BArX4]) ([3][BArX4]). Similar reactions of 1 and Na[BArX4] with [Fe(NCC6H4NO2)(dppe)Cp][BArX4] gave bimetallic [{Fe(dppe)Cp}2{μ-NCC6H4N(O)}][BArF4]2. However, reactions of 1 and Na[BArX4] with 4-nitrophenol gave the first example of the bench-stable iron half-sandwich phenolate complex [Fe(OC6H4NO2)(dppe)Cp]+ rather than NO2 activation. The formation of complexes [3]+ likely proceeds via the unusual blue bimetallic species [{Fe(dppe)Cp}2{μ,κ2O,O′-O2NAr}]2+. This compound undergoes N-O bond cleavage, resulting in [3]+ and a FeIV=O species, which reacts via an internal C-H activation of the dppe ligand to give [FeIII(κ3O,P,P′-P(2-O-C6H4)(Ph)-C2H4-PPh2)Cp]+. Complexes [3]+ are stable under ambient conditions, are readily purified by column chromatography and can be isolated in up to 50% yield, considering that 0.5 equiv of 1 is required as the oxygen acceptor.

Transition-metal-free and facile synthesis of 3-alkynylpyrrole-2,4-dicarboxylates from methylene isocyanides and propiolaldehyde

A transition-metal-free, facile and efficient method for the synthesis of 3-alkynylpyrrole-2,4-dicarboxylates from methylene isocyanides and propiolaldehyde with moderate to good yields has been developed. The direct transformation process and good tolerance of various substituents make it an alternative approach to previous protocols, and potential applications of these investigated compounds are expected with or without post-modifications.