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4-Hydroxy-3-(propan-2-yl)phenyl thiocyanate is an organic compound with the chemical formula C10H13NOSC. It is a derivative of phenol, featuring a hydroxyl group at the 4-position and a propyl group at the 3-position. The molecule also contains a thiocyanate functional group, which is a cyanide ion (CN-) with a sulfur atom replacing the carbon atom. 4-hydroxy-3-(propan-2-yl)phenyl thiocyanate is characterized by its aromatic structure and the presence of a sulfur atom in the thiocyanate group, which imparts unique chemical properties. It is used in various chemical reactions and can be found in research and industrial applications, particularly in the synthesis of pharmaceuticals and agrochemicals. The compound's structure and reactivity make it a valuable intermediate in organic synthesis, where it can participate in a range of reactions, such as nucleophilic substitutions and addition reactions, due to the presence of the thiocyanate group.

6319-41-1

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6319-41-1 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 6319-41-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,3,1 and 9 respectively; the second part has 2 digits, 4 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 6319-41:
(6*6)+(5*3)+(4*1)+(3*9)+(2*4)+(1*1)=91
91 % 10 = 1
So 6319-41-1 is a valid CAS Registry Number.

6319-41-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name (4-hydroxy-3-propan-2-ylphenyl) thiocyanate

1.2 Other means of identification

Product number -
Other names 2-iso-propyl-4-thiocyanatophenol

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:6319-41-1 SDS

6319-41-1Relevant academic research and scientific papers

Synthesis, biological evaluation and molecular modeling of GW 501516 analogues

Ciocoiu, Calin C.,Ravna, Aina W.,Sylte, Ingebrigt,Hansen, Trond Vidar

experimental part, p. 612 - 624 (2011/09/15)

Eleven analogues of GW 501516 (1) were prepared and subjected to biological testing in a semi-high throughput human skeletal muscle cell assay. The assay testing indicated that all analogues elicited oxidation of oleic acid. Among the most potent agonists, 2e (2-{2-ethyl-4-[(4-methyl-2-(4-trifluoromethylphenyl) thiazol-5-yl)methylthio]phenoxy}-2-methylpropanoic acid), was also subjected to a luciferase-based transfection assay, which showed that this compound is a potent agonist against PPARδ and a moderate agonist against PPARα. Docking of compound 2e into PPARδ revealed that it occupied the agonist binding site and exhibited key hydrogen bonding interactions with His323, His449, and Tyr473. Eleven GW 501516 analogues were prepared and subjected to human skeletal muscle cells. The assay testing indicated that all analogues elicited oxidation of oleic acid. One of the analogues displayed dual agonist effects against both PPARα and PPARδ. Copyright

Arylation of Phenols. Convenient, Regiospecific Methods for Mono- or Bis-p-fluorophenylations, Suitable for Large Scale Syntheses

Jendralla, Heiner,Chen, Li-Jian

, p. 827 - 833 (2007/10/02)

Phenols have been arylated by a palladium(0)-catalyzed coupling reaction.Two methods were used: a Grignard reagent of a protected phenol component 2 was coupled with a haloarene, or an umpolung (reversed reactivity) where unprotected phenolic halides 6 were coupled with aryl Grignard reagents.Bis-arylation and regiospecific ortho-, meta- and para-arylations were achieved.Aryl-aryl-couplings were insensitive to steric hindrance in the Grignard component, but were inhibited by sulfur-containing substituents in the phenolic component.A thiocyanate substituted biaryl was used to synthesize arylated phenols with various sulfur functionalities.

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