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5'-HYDROXY-2'-METHOXYACETOPHENONE is an organic compound that serves as an essential intermediate in the synthesis of various chemical compounds. It is characterized by its unique molecular structure, which features a hydroxyl group at the 5' position and a methoxy group at the 2' position, attached to an acetophenone backbone.

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  • 31405-60-4 Structure
  • Basic information

    1. Product Name: 5'-HYDROXY-2'-METHOXYACETOPHENONE
    2. Synonyms: 5'-HYDROXY-2'-METHOXYACETOPHENONE;5-HYDROXY-2-METHOXYACETOPHENONE;1-(5-Hydroxy-2-methoxyphenyl)ethanone
    3. CAS NO:31405-60-4
    4. Molecular Formula: C9H10O3
    5. Molecular Weight: 166.17
    6. EINECS: N/A
    7. Product Categories: Aromatic Acetophenones & Derivatives (substituted)
    8. Mol File: 31405-60-4.mol
  • Chemical Properties

    1. Melting Point: 83°C
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: -20°C Freezer, Under inert atmosphere
    8. Solubility: Chloroform (Slightly), Methanol (Slightly)
    9. CAS DataBase Reference: 5'-HYDROXY-2'-METHOXYACETOPHENONE(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5'-HYDROXY-2'-METHOXYACETOPHENONE(31405-60-4)
    11. EPA Substance Registry System: 5'-HYDROXY-2'-METHOXYACETOPHENONE(31405-60-4)
  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 22
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 31405-60-4(Hazardous Substances Data)

31405-60-4 Usage

Uses

Used in Pharmaceutical Industry:
5'-HYDROXY-2'-METHOXYACETOPHENONE is used as a key intermediate for the synthesis of (phenylethyl)acetophenones and scorzodihydrostilbenes B/D. These synthesized compounds have potential applications in the development of new drugs and therapeutic agents, making 5'-HYDROXY-2'-METHOXYACETOPHENONE a valuable compound in the pharmaceutical industry.
Used in Chemical Synthesis:
In the field of chemical synthesis, 5'-HYDROXY-2'-METHOXYACETOPHENONE is used as a building block for creating a wide range of chemical compounds. Its unique structure allows for various chemical reactions, enabling the development of novel molecules with diverse applications in different industries, such as materials science, agrochemicals, and more.

Preparation

Also prepared by treatment of 5-(pivaloyloxy)-2-methoxyacetophenone in DMF with a 2 M sodium hydroxide aqueous solution at 100° for 12 h (83%).

Check Digit Verification of cas no

The CAS Registry Mumber 31405-60-4 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,1,4,0 and 5 respectively; the second part has 2 digits, 6 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 31405-60:
(7*3)+(6*1)+(5*4)+(4*0)+(3*5)+(2*6)+(1*0)=74
74 % 10 = 4
So 31405-60-4 is a valid CAS Registry Number.

31405-60-4Relevant articles and documents

Sequential Ir/Cu-Mediated Method for the Meta-Selective C-H Radiofluorination of (Hetero)Arenes

Wright, Jay S.,Sharninghausen, Liam S.,Preshlock, Sean,Brooks, Allen F.,Sanford, Melanie S.,Scott, Peter J. H.

, p. 6915 - 6921 (2021/05/29)

This article describes a sequential Ir/Cu-mediated process for the meta-selective C-H radiofluorination of (hetero)arene substrates. In the first step, Ir-catalyzed C(sp2)-H borylation affords (hetero)aryl pinacolboronate (BPin) esters. The intermediate organoboronates are then directly subjected to copper-mediated radiofluorination with [18F]tetrabutylammonium fluoride to afford fluorine-18 labeled (hetero)arenes in high radiochemical yield and radiochemical purity. This entire process is performed on a benchtop without Schlenk or glovebox techniques and circumvents the need to isolate (hetero)aryl boronate esters. The reaction was automated on a TracerLab FXFN module with 1,3-dimethoxybenzene and a meta-tyrosine derivative. The products, [18F]1-fluoro-3,5-dimethoxybenzene and an 18F-labeled meta-tyrosine derivative, were obtained in 37 ± 5% isolated radiochemical yield and >99% radiochemical purity and 25% isolated radiochemical yield and 99% radiochemical purity, and 0.52 Ci/μmol (19.24 GBq/μmol) molar activity (Am), respectively.

Transition metal free regio-selective C-H hydroxylation of chromanones towards the synthesis of hydroxyl-chromanones using PhI(OAc)2 as the oxidant

Viswanadh,Ghotekar, Ganesh S.,Thoke, Mahesh B.,Velayudham,Shaikh, Aslam C.,Karthikeyan,Muthukrishnan

supporting information, p. 2252 - 2255 (2018/03/06)

The chromanone scaffold is considered as a privileged structure in drug discovery. Herein, we report a highly efficient PhI(OAc)2 mediated regioselective, direct C-H hydroxylation of chromanones. This method offers easy access to substituted 6-hydroxy chromanones in moderate to good isolated yields, thus paving the way for their pharmaceutical studies.

SUBSTITUTED BENZOHYDRAZIDE ANALOGS AS HISTONE DEMETHYLASE INHIBITORS

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Paragraph 00194, (2017/01/23)

Benzohydrazide analogs, derivatives thereof, and related compounds, which are useful as inhibitors of lysine-specific histone demethyfase, including LSD1 and LSD2; synthetic methods for making the compounds; pharmaceutical compositions comprising the compounds; and methods of using the compounds and compositions to treat disorders associated with dysfunction of the LSD1 and/or LSD2.

Activity-Based Proteome Profiling Probes Based on Woodward's Reagent K with Distinct Target Selectivity

Qian, Yong,Schürmann, Marc,Janning, Petra,Hedberg, Christian,Waldmann, Herbert

supporting information, p. 7766 - 7771 (2016/07/07)

Woodward's reagent K (WRK) is a reactive heterocyclic compound that has been employed in protein chemistry to covalently and unspecifically label proteins at nucleophilic amino acids, notably at histidine and cysteine. We have developed a panel of WRK-der

Model studies towards the synthesis of gilvocarcin M

Cordera-Vargas, Alejandro,Quiclet-Sire, Beatrice,Zard, Samir Z.

, p. 4432 - 4443 (2007/10/03)

In model studies towards the synthesis of gilvocarcin M, a convergent, xanthate-based free-radical strategy was tested in order to construct the key aromatic ring attached to the sugar unit. The Royal Society of Chemistry 2005.

Pyridyl and pyridazinyl substituted thyronine compounds having selective thyromimetic activity

-

, (2008/06/13)

This invention relates to chemical compounds which have selective thyromimetic activity. A compound of this invention is 3,5-dibromo-3''-[6-oxo-3(1H)-pyridazinylmethyl]-thyronine.

SELECTIVE ALKYLATIONS OF CERTAIN PHENOLIC AND ENOLIC FUNCTIONS WITH LITHIUM CARBONATE/ALKYL HALIDE

Wymann, Walter E.,Davis, Roman,Patterson, John W.,Pfister, Juerg R.

, p. 1379 - 1384 (2007/10/02)

Phenolic groups with pKaa's(ca.10), they can be alkylated with this reagent combination.

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