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2,5-Diisopropylphenol, also known as Propofol EP Impurity D, is an organic compound with the molecular formula C12H18O. It is structurally similar to propofol, an anesthetic agent, but with a slight difference in the position of the isopropyl groups. 2,5-DIISOPROPYLPHENOL is of interest due to its potential effects on the metabolism of propofol.

35946-91-9

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35946-91-9 Usage

Uses

Used in Pharmaceutical Industry:
2,5-Diisopropylphenol is used as an inhibitor for propofol glucuronidation. It plays a significant role in the study and development of propofol, an anesthetic agent, by affecting its metabolism. By inhibiting the glucuronidation process, it can help researchers understand the metabolic pathways and improve the safety and efficacy of propofol as an anesthetic.

Check Digit Verification of cas no

The CAS Registry Mumber 35946-91-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,5,9,4 and 6 respectively; the second part has 2 digits, 9 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 35946-91:
(7*3)+(6*5)+(5*9)+(4*4)+(3*6)+(2*9)+(1*1)=149
149 % 10 = 9
So 35946-91-9 is a valid CAS Registry Number.
InChI:InChI=1/C12H18O/c1-8(2)10-5-6-11(9(3)4)12(13)7-10/h5-9,13H,1-4H3

35946-91-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,5-di(propan-2-yl)phenol

1.2 Other means of identification

Product number -
Other names 2-Hydroxy-1.4-diisopropyl-benzol

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Intermediates
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:35946-91-9 SDS

35946-91-9Relevant academic research and scientific papers

Method for preparing hydrocarbyl phenol by catalytic conversion of phenolic compound in presence of molybdenum-based catalyst

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Paragraph 0043-0044; 0070, (2018/04/02)

The invention discloses a method for preparing hydrocarbyl phenol by catalytic conversion of a phenolic compound in the presence of a molybdenum-based catalyst. The method comprises mixing a phenoliccompound, a molybdenum-based catalyst and a reaction solvent, adding the mixture into a sealed reactor, feeding gas into the reactor, heating the mixture to 150-350 DEG C, carrying out stirring for areaction for 0.5-2h, then filtering to remove a solid catalyst and carrying out rotary evaporateion to obtain a liquid product. The phenolic compound has a wide source, a cost is low, product alkyl phenol selectivity is high, an added value is high, alcohol or an alcohol-water mixture is used as a reaction solvent, environmental friendliness is realized, pollution is avoided, any inorganic acids and alkalis are avoided in the reaction process, the common environmental pollution problems in the biomass processing technology are solved, the reaction conditions are mild, the process can be carried out at a low temperature, high-efficiency conversion of the reactants can be realized without consuming hydrogen gas and the method is suitable for large-scale industrial trial production.

2,5-DIALKYL-4-H/HALO/ETHER-PHENOL COMPOUNDS

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, (2016/12/22)

The present disclosure provides phenolic compounds useful in the treatment of neurological conditions such as convulsions and tremors, having the structure of Formula (I): wherein R2, R4, R5, and R6, are as defined in the detailed description; pharmaceutical compositions comprising at least one of the compounds; and methods for treating neurological conditions.

C-H Functionalization at Sterically Congested Positions by the Platinum-Catalyzed Borylation of Arenes

Furukawa, Takayuki,Tobisu, Mamoru,Chatani, Naoto

, p. 12211 - 12214 (2015/10/12)

Despite significant progress in the area of C-H bond functionalization of arenes, no general method has been reported for the functionalization of C-H bonds at the sterically encumbered positions of simple arenes, such as mesitylene. Herein, we report the development of the first platinum-based catalyst for C-H borylation of arenes and heteroarenes. Notably, this method exhibited high tolerance toward steric hindrance and provided rapid access to a series of 2,6-disubstituted phenylboronic esters, valuable building blocks for further elaborations.

2,5-DIALKYL-4-H/HALO/ETHER-PHENOL COMPOUNDS

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, (2015/06/03)

The present disclosure provides phenolic compounds useful in the treatment of neurological conditions such as convulsions and tremors, having the structure of Formula (I): wherein R2, R4, and R5, are as defined in the detailed description; pharmaceutical compositions comprising at least one of the compounds; and methods for treating neurological conditions.

The reaction of nitrile oxide-quinone cycloadducts. III. Reinvestigation of the base-induced isomerization of the 1:1 -C=C-adducts of aromatic nitrile oxides with 2,5-and 2,6-dialkyl-substituted p-benzoquinones

Mukawa, Takashi,Inoue, Yukihiko,Shiraishi, Shinsaku

, p. 2549 - 2556 (2007/10/03)

The structure of the product obtained by the base, induced isomerization of the 1,3-dipolar cycloadduct of 2,5-di-t-butyl-p-benzoquinone with 2,6- dichlorobenzonitrile oxide was determined by X-ray analysis. The t-butyl group at the bridgehead position of the 1,3-dipolar cycloadduct migrated to the neighboring carbonyl carbon atom. This base-induced rearrangement took place with a bulky group, i.e., Et, i-Pr, t-Bu, and Bn at the bridgehead position of nitrile oxide-quinone cycloadducts in an alcoholic media. The driving force of this reaction is considered to be due to stabilization by aromatization from isoxazoline derivatives to isoxazole-fused p-quinol derivatives.

Alumina-Catalyzed Reactions of Hydroxyarenes and Hydroaromatic Ketones. 10. Reaction of Phenol with 2-Propanol

Klemm, LeRoy H.,Taylor, Dennis R.

, p. 4326 - 4329 (2007/10/02)

At 300-350 deg C in the presence of alumina, phenol (1) reacts with excess 2-propanol (37) to give mixed monopropyl-, dipropyl-, and 2,4,6-triisopropyl- (42) phenols. At 300 deg C the principal components of the product mixture are 2-isopropylphenol (26-30 mol percent yield) and 2,6-diisopropylphenol (44-52percent); at 350-400 deg C , they are the isomeric monoisopropylphenols (50-60percent). With 3-isopropylphenol as substrate (instead of 1), 2,5-diisopropylphenol is obtained (79percent), while 4-isopropylphenol gives 2,4-diisopropylphenol and 42 (70percent combined yield). In various runs, 0-20percent of the propyl groups introduced are n-propyl ones. It is proposed that the principal products result from an SN2-type reaction mechanism which involves nucleophilic attack (variously by C-2, C-4, and C-6) of an adsorbed ambident phenoxide ion onto C-2 of an adsorbed isopropoxide group. n-Propylation is ascribed to a side reaction of SN1 type.

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