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4-(Phenylthio)phthalonitrile 97, with the molecular formula C18H9NS, is a white to light yellow crystalline powder. It is a chemical compound known for its strong and stable structure, making it suitable for various applications in the chemical industry. It is also used as an intermediate in the synthesis of organic compounds and can be found in some pharmaceutical and agricultural products. Additionally, 4-(Phenylthio)phthalonitrile 97 is known for its low toxicity and environmental impact, making it a preferred choice for certain industrial processes.

77474-63-6

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77474-63-6 Usage

Uses

Used in Chemical Industry:
4-(Phenylthio)phthalonitrile 97 is used as a key component in the production of dyes, pigments, and other industrial chemicals. Its strong and stable structure makes it suitable for various applications in this industry.
Used in Pharmaceutical Industry:
4-(Phenylthio)phthalonitrile 97 is used as an intermediate in the synthesis of organic compounds, which can be further used in the development of pharmaceutical products.
Used in Agricultural Industry:
4-(Phenylthio)phthalonitrile 97 can be found in some agricultural products, where it may be used for its properties or as an intermediate in the synthesis of other compounds.
Used in Environmentally Friendly Processes:
Due to its low toxicity and environmental impact, 4-(Phenylthio)phthalonitrile 97 is a preferred choice for certain industrial processes that prioritize eco-friendliness.

Check Digit Verification of cas no

The CAS Registry Mumber 77474-63-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,7,4,7 and 4 respectively; the second part has 2 digits, 6 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 77474-63:
(7*7)+(6*7)+(5*4)+(4*7)+(3*4)+(2*6)+(1*3)=166
166 % 10 = 6
So 77474-63-6 is a valid CAS Registry Number.

77474-63-6SDS

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 4-phenylsulfanylbenzene-1,2-dicarbonitrile

1.2 Other means of identification

Product number -
Other names 4-phenylsulfanylphthalonitrile

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:77474-63-6 SDS

77474-63-6Relevant academic research and scientific papers

METALLOPHTHALOCYANINE-ZNO HOLLOW NANOSPHERES COMPOSITE

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Paragraph 0032, (2021/03/19)

A composite nanomaterial of ZnO impregnated by, e.g., a green copper phthalocyanine compound (CuPc) can be an efficient solar light photocatalyst for water remediation. The composite may include hollow shell microspheres and hollow nanospheres of CuPc-ZnO

Synthesis and characterization of tetra-substituted palladium phthalocyanine complexes

Lokesh, Koodlur Sannegowda,Adriaens, Annemie

, p. 269 - 277 (2012/11/06)

Tetra-substituted palladium phthalocyanine complexes with different electron withdrawing and electron donating substituents (-H, -NO2, -NH2, -Cl, -COOH, aryl thio) have been synthesized with a good yield. The synthesized complexes were characterized using XPS, UV-Vis, IR, Raman, XRD, TGA and electrochemistry. The XPS spectra show that the central metal ion is in the +2 state, while the UV-Vis spectra demonstrate split absorption peaks in the Q-band region 600-700 nm due to the presence of dimeric and oligomeric molecules in addition to the monomeric species. The UV-Vis and Raman spectra demonstrate a shift in the peaks/bands which is a result of the electron withdrawing and electron donating substituents at the periphery of the benzene ring compared to the parent palladium phthalocyanine. The thermogravimetic stability studies show that these complexes undergo two separate decomposition processes. The thermal stability for different complexes are in the order: PdPc a redox process and the redox behaviour observed is mainly due to the macrocyclic ring reduction process.

Sulfanylphthalonitrile analogues as selective and potent inhibitors of monoamine oxidase B

Van Der Walt, Mietha M.,Terre'Blanche, Gisella,Lourens, Anna C.U.,Petzer, Anél,Petzer, Jacobus P.

supporting information, p. 7367 - 7370 (2013/02/21)

It has recently been reported that nitrile containing compounds frequently act as potent monoamine oxidase B (MAO-B) inhibitors. Modelling studies suggest that this high potency inhibition may rely, at least in part, on polar interactions between nitrile functional groups and polar moieties within the MAO-B substrate cavity. In an attempt to identify potent and selective inhibitors of MAO-B and to contribute to the known structure-activity relationships of MAO inhibition by nitrile containing compounds, the present study examined the MAO inhibitory properties of series of novel sulfanylphthalonitriles and sulfanylbenzonitriles. The results document that the evaluated compounds are potent and selective MAO-B inhibitors with most homologues possessing IC50 values in the nanomolar range. In general, the sulfanylphthalonitriles exhibited higher binding affinities for MAO-B than the corresponding sulfanylbenzonitrile homologues. Among the compounds evaluated, 4-[(4-bromobenzyl)sulfanyl]phthalonitrile is a particularly promising inhibitor since it displayed a high degree of selectivity (8720-fold) for MAO-B over MAO-A, and potent MAO-B inhibition (IC50 = 0.025 μM). Based on these observations, this structure may serve as a lead for the development of therapies for neurodegenerative disorders such as Parkinson's disease.

μ-oxo-bridged subphthalocyanine dimers: Preparation and characterization by X-ray structure analysis

Yamasaki, Yasuhiro,Mori, Tomohiro

experimental part, p. 1208 - 1214 (2012/01/31)

In connection with our previous research on μ-oxo-bridged metal phthalocyanine dimers, we have synthesized μ-oxo-bridged subphthalocyanine dimers (μ-oxo subpc dimers) with various peripheral substituents and studied their properties. Compared to the corre

Subphthalocyanines having axial substituent with direct B-C bond: General preparation and physical properties

Yamasaki, Yasuhiro,Mori, Tomohiro

supporting information; experimental part, p. 1108 - 1109 (2011/01/11)

A novel synthetic methodology and the characterization of subphthalocyanines (SubPcs) having an axial substituent with a direct boron-carbon bond are reported. The SubPcs are found to be more light- and/or heat resistant than analogs with a heteroatom bet

Synthesis, electrochemical and photophysical properties of phthalocyaninato oxotitanium(iv) complexes tetra-substituted at the α and β positions with arylthio groups

Tau, Prudence,Nyokong, Tebello

, p. 4482 - 4490 (2007/10/03)

The synthesis, electrochemical and photophysical properties of the following tetra-substituted thiol oxotitanium phthalocyanines are reported for the first time: 1,(4)-(tetraphenylthiophthalocyaninato)titanium(iv)oxide (5a); 1,(4)-(tetrabenzylthiophthalocyaninato)titanium(iv)oxide (5b); 2,(3)-(tetraphenylthiophthalocyaninato)titanium(iv)oxide (6a) and 2,(3)-(benzylthiophthalocyaninato)titanium(iv)oxide (6b). Cyclic voltammograms of all four complexes are similar, with three reversible reduction couples each involving a one electron transfer process. The first two reductions were confirmed by spectroelectrochemistry to be metal-based reductions due to Ti IVPc-2/TiIIIPc-2 and Ti IIIPc-2/TiIIPc-2 redox processes, while the last reduction was confirmed to be a ring-based reduction due to TiIIPc-2/TiIIPc-3. Low fluorescence quantum yields (0.05-0.14), relatively long triplet lifetimes (150-210 s) and triplet yields (0.31 to 0.82) were observed. The Royal Society of Chemistry 2006.

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