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1-(3-methoxyphenyl)tridecane-1-carbonitrile is a chemical compound characterized by the molecular formula C21H31NO. It features a tridecane chain with a methoxyphenyl group attached to the first carbon and a carbonitrile group at the last carbon. This unique structure endows it with specific properties that make it valuable in various applications.

97692-46-1

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97692-46-1 Usage

Uses

Used in Organic Chemistry:
1-(3-methoxyphenyl)tridecane-1-carbonitrile is used as a synthetic intermediate for the creation of other organic molecules. Its distinct chemical structure allows it to serve as a building block in the synthesis of complex organic compounds, contributing to the advancement of organic chemistry.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, 1-(3-methoxyphenyl)tridecane-1-carbonitrile is used as a potential candidate for drug development. Its unique chemical properties may offer novel pathways for the treatment of various medical conditions, making it a valuable asset in the search for new therapeutic agents.
Used in Agrochemical Industry:
1-(3-methoxyphenyl)tridecane-1-carbonitrile may also find applications in the agrochemical industry. Its chemical structure could be harnessed to develop new compounds for use in agriculture, such as pesticides or herbicides, that could improve crop protection and yield.
Safety Considerations:
It is crucial to handle 1-(3-methoxyphenyl)tridecane-1-carbonitrile with care and adhere to proper safety protocols when working with it in a laboratory setting. This ensures the safety of researchers and the integrity of the experiments conducted.

Check Digit Verification of cas no

The CAS Registry Mumber 97692-46-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,7,6,9 and 2 respectively; the second part has 2 digits, 4 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 97692-46:
(7*9)+(6*7)+(5*6)+(4*9)+(3*2)+(2*4)+(1*6)=191
191 % 10 = 1
So 97692-46-1 is a valid CAS Registry Number.
InChI:InChI=1/C21H33NO/c1-3-4-5-6-7-8-9-10-11-12-14-20(18-22)19-15-13-16-21(17-19)23-2/h13,15-17,20H,3-12,14H2,1-2H3

97692-46-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(3-methoxyphenyl)tetradecanenitrile

1.2 Other means of identification

Product number -
Other names 1-(3-Methoxyphenyl)tridecane-1-carbonitrile

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:97692-46-1 SDS

97692-46-1Downstream Products

97692-46-1Relevant academic research and scientific papers

Catalytic Formal Conjugate Addition: Direct Synthesis of δ-Hydroxynitriles from Nitriles and Allylic Alcohols

Thiyagarajan, Subramanian,Sankar, Raman Vijaya,Anjalikrishna, Puthannur K.,Suresh, Cherumuttathu H.,Gunanathan, Chidambaram

, p. 2191 - 2204 (2022/02/14)

Alcohols and nitrile functionalities have widespread applications in biochemical and chemical synthesis. Catalytic transformations involving C-C bond formation relying on unsaturated coupling partners create important pathways for processes in synthetic, material, and medicinal chemistry. The discovery of a simple and selective coupling of nitriles with allylic alcohols catalyzed by a ruthenium pincer complex is described, which tolerates reactive functional groups such as carbamate, sulfonate, olefin, cyano, and trifluoromethyl-substituted benzyl nitriles. Homo allylic alcohols also provided 1,4-addition products following the isomerization of double bonds. Mechanistic studies supported that the allylic alcohols initially undergo selective oxidation by the catalyst to α,β-unsaturated carbonyl compounds followed by 1,4-conjugate addition of benzyl nitriles catalyzed by a base and subsequent catalytic reduction of carbonyl functionality, leading to the formation of δ-hydroxynitrile products. The catalytic cycle of this tandem process is established by density functional theory studies. Remarkably, anipamil drug is successfully synthesized using this catalytic protocol. The utility of the δ-hydroxynitrile products in the synthesis of biologically active molecules and their further functionalization are also demonstrated.

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