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2-(Naphthalen-1-yl)-3-phenylpropanenitrile is an organic compound with the molecular formula C20H15N. It is a derivative of propanenitrile, featuring a naphthalene ring at the 2-position and a phenyl group at the 3-position. 2-(Naphthalen-1-yl)-3-phenylpropanenitrile is characterized by its aromatic structure, which includes a naphthalene ring (a fused pair of benzene rings) and a phenyl group (a benzene ring). The presence of the nitrile group (-CN) at the end of the molecule gives it specific chemical reactivity and properties. It is a colorless solid and is used in the synthesis of various pharmaceuticals and chemical intermediates due to its unique structure and reactivity.

3952-54-3

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3952-54-3 Usage

Nitrile derivative

3-phenylpropanenitrile
2-(Naphthalen-1-yl)-3-phenylpropanenitrile is derived from 3-phenylpropanenitrile by incorporating a naphthalene ring into its structure.

Incorporation of naphthalene ring

The compound contains a naphthalene ring, which is a fused benzene ring system consisting of ten carbon atoms and six hydrogen atoms.

Potential applications

Organic synthesis and pharmaceuticals
2-(Naphthalen-1-yl)-3-phenylpropanenitrile may have interesting biological properties, making it a candidate for use in the fields of organic synthesis and pharmaceuticals.

Toxicity

Nitriles
As a nitrile, 2-(Naphthalen-1-yl)-3-phenylpropanenitrile can be toxic, and it is essential to handle the chemical with caution to minimize health risks.

Interest for researchers and industry professionals

Due to its unique structure and potential uses, 2-(Naphthalen-1-yl)-3-phenylpropanenitrile is a compound of interest for those working in the fields of chemistry and pharmaceuticals.

Check Digit Verification of cas no

The CAS Registry Mumber 3952-54-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,9,5 and 2 respectively; the second part has 2 digits, 5 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 3952-54:
(6*3)+(5*9)+(4*5)+(3*2)+(2*5)+(1*4)=103
103 % 10 = 3
So 3952-54-3 is a valid CAS Registry Number.

3952-54-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(naphth-1-yl)-3-phenyl propionitrile

1.2 Other means of identification

Product number -
Other names 2-[1]naphthyl-3-phenyl-propionitrile

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:3952-54-3 SDS

3952-54-3Relevant academic research and scientific papers

Copper-catalyzed radical oxidative C(sp3)–H/C(sp3)–H cross-coupling between arylacetonitriles and benzylic compounds

Guo, Fengzhe,Li, Fangshao,Li, Qiang,Tang, Zi-Long,Wu, Xiaofang,Xiao, Jing,Zhong, Ting

, (2020/10/14)

For the first time, a novel copper-catalyzed direct C(sp3)–H/C(sp3)–H cross-coupling of arylacetonitriles with unactivated benzylic compounds was described, allowing various a-benzylated arylacetonitriles to be readily accessible under base-free conditions. Mechanistic investigations suggested that the reaction proceeds through radical process and the C(sp3)–H cleavage of arylacetonitriles probably is the rate-determining step.

Ru(II)-PBTNNXN complex bearing functional 2-(pyridin-2-yl)benzo[d]thiazole ligand catalyzed α-alkylation of nitriles with alcohols

Huang, Shuang,Hong, Xi,Sun, Yong,Cui, He-Zhen,Zhou, Quan,Lin, Yue-Jian,Hou, Xiu-Feng

, (2020/02/13)

Six tridentate NNN ligand precursors derived from 2-(pyridin-2-yl)benzo[d]thiazole(PBT) with different linkers, PBTNNXN (X = NH, NMe, O, S) (1a–1f), have been successfully prepared. The electronic properties of PBTNNXN ligands are well tunable by differing linkers between PBT skeleton and the pyridine ring, and/or by introducing electron-donating/withdrawing groups on the pyridine ring (R = OMe or F). The ligand precursors and representative complexes Ru (PBTNNNHN)Cl2(PPh3) (2a), Ru (PBTNNNMeN)Cl2(PPh3) (2b), and Ru (PBTNNSN)Cl2(PPh3) (2f) have been characterized by NMR spectroscopy, high-resolution mass spectroscopy, and Fourier transform infrared (FT-IR). The molecular structures of 1f, 2a, and 2f have been determined by X-ray diffraction study. The results indicate that PBTNNNHN ligand in the complex presented coplanar with two five-membered chelating rings. It should be noted that 2a featuring a NH group exhibits superior performance compared to those with other linkers (such as NMe, O, or S). A variety of heterocyclic and aromatic nitriles with aromatic and aliphatic alcohols have been explored in α-alkylation for good to excellent yields. Based on kinetic experiments and mechanistic studies, a proposed mechanism was put forward. Ru-H species and benzaldehyde, which was oxidized from benzyl alcohol, were detected in the catalytic cycle.

Synthesis of β-substituted Naphth-1-yl ethylamido derivatives as new melatoninergic agonists

Mathe-Allainmat, Monique,Le Gall, Marie,Jellimann, Carole,Andrieux, Jean,Langlois, Michel

, p. 2945 - 2952 (2007/10/03)

Naphthalene melatoninergic ligands with alkyl groups (Me, Et, Pr, Bz) in the β position of the ethylamido chain were synthesised. The affinity of the compounds for chicken brain melatonin receptors was evaluated using 2-[125I]-iodomelatonin as the radioligand. An increase in the affinity was observed with the β-methyl derivatives and the greatest increase was seen with the (-) enantiomers. The introduction of a 2- or 7-MeO group on the naphthalene ring and the lengthening (Et, Pr) of the alkylamido chain gave potent compounds such as (-)1h (K(i)=24pM). The functional activity of these compounds was evaluated by the aggregation of melanophores in Xenopus laevis tadpoles. The potency to produce lightening of the skin of Xenopus laevis was related to the affinities values of the molecules at melatonin chicken brain receptors. The most potent ligands were found to be full agonists and compound 1h was 25 fold more potent than melatonin in this bioassay. Copyright (C) 1999 Elsevier Science Ltd.

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