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Phenol, 4-(1,1-dimethylethyl)-, carbonate (2:1) is a chemical compound with the molecular formula C15H22O3. It is a derivative of phenol, where a 1,1-dimethylethyl (also known as tert-butyl) group is attached to the 4-position of the phenol ring. Phenol, 4-(1,1-dimethylethyl)-, carbonate (2:1) is formed by the reaction of phenol with carbonyl chloride in a 2:1 ratio, resulting in the formation of a carbonate ester. It is an organic compound with potential applications in the synthesis of various pharmaceuticals, agrochemicals, and other organic compounds due to its reactivity and stability. The compound is also known for its ability to protect the phenol group from further reactions, making it a useful intermediate in organic synthesis.

2561-97-9

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2561-97-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 2561-97-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,5,6 and 1 respectively; the second part has 2 digits, 9 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 2561-97:
(6*2)+(5*5)+(4*6)+(3*1)+(2*9)+(1*7)=89
89 % 10 = 9
So 2561-97-9 is a valid CAS Registry Number.

2561-97-9SDS

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 4-tert-butylphenol,carbonic acid

1.2 Other means of identification

Product number -
Other names Kohlensaeure-bis-(4-tert-butyl-phenylester)

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:2561-97-9 SDS

2561-97-9Downstream Products

2561-97-9Relevant academic research and scientific papers

CARBONATE DERIVATIVE PRODUCTION METHOD

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Paragraph 0139-0140, (2020/04/09)

The objective of the present invention is to provide a method for producing a carbonate derivative in a safe and efficient manner. The method for producing a carbonate derivative according to the present invention is characterized in comprising irradiating light on a composition containing a C1-4 halogenated hydrocarbon having one or more kinds of halogen atoms selected from the group consisting of a chlorine atom, a bromine atom and an iodine atom, a nucleophilic functional group-containing compound and the specific base in the presence of oxygen.

Photochemical molecular storage of Cl2, HCl, and COCl 2: Synthesis of organochlorine compounds, salts, ureas, and polycarbonate with photodecomposed chloroform

Kuwahara, Yuki,Zhang, Ailing,Soma, Haruka,Tsuda, Akihiko

supporting information; experimental part, p. 3376 - 3379 (2012/08/08)

Chloroform is available as not only an organic solvent but also photochemical molecular storage for synthetically important chemicals such as Cl2, HCl, and COCl2. We have succeeded in synthesizing organochlorine compounds, hydrochloric salt of amines, ureas, organic carbonates, and polycarbonate in practical high yields with photodecomposed chloroform.

Process for producing an organic carbonate

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, (2008/06/13)

A process for producing an organic carbonate which comprises reacting an organic hydroxy compound, carbon monoxide and oxygen in the presence of a catalyst comprising(a) palladium or a palladium compound, (b) a cuprous or cupric compound such as cupric acetate, (c) a quinone or an aromatic diol formed by reduction of the quinone or a mixture thereof such as hydroquinone, and (d) a halogenated onium compound such as (C4 H9)NBr is disclosed. According to the invention, an organic carbonate such as diphenyl carbonate can be produced efficiently and economically.

Hydrolysis of orthocarbonates. Evidence for charge imbalance in the transition state for the general acid catalyzed process

Kandanarachchi, Pramod,Sinnott, Michael L.

, p. 5601 - 5606 (2007/10/02)

Catalytic constants have been measured for the hydrolysis of a range of aryl orthocarbonates, in which both the leaving group and trioxocarbenium ion moiety have been systematically varied, by neutral carboxylic acids (trichloroacetic, difluoroacetic, dichloroacetic, malonic, chloroacetic, and acetic) at 70.0°C in 60% water-40% acetonitrile, I = 1.0 M (KCI). Curvature cannot be detected in Br?nsted plots involving carboxylic acids only, but inclusion of the point for H3O+ suggests downward curvature (i.e. px ≥ 0). β1g Plots are curved downward (i.e. py′ = -?β1g/?pK1g > 0). Substitutent effects in the tris(aryloxy)carbenium ion fragment were quantitated by use of the experimental aqueous pKa alues of the phenol (pKrc), rather than Hammett σ values, since this gave better correlations for the spontaneous reactions (Kandanarachchi, P.; Sinnott, M. L. J. Am. Chem. Soc., preceding paper in this issue). Cross coefficients are large and not constant: pxy′ (measured as ?α/?pK1g rather than -?β1g/?pKHA) varies from 0.26 for (PhO)3C+ to 0.16 for (PMeOC6H4O)3C+. Likewise,pxy (measured as -?α/?pKrc rather than -?βrc/?pKHA) experiences large changes with the leaving group pK. Data to estimate pyy′ (?βrc/?pK1g) are more limited, but it too changes with the pKa of the catalyzing acid. These data indicate that a two-dimensional More O'Ferrall-Jencks diagram, with one axis representing both C-O cleavage and the ability of substituents in the tris(aryloxy)carbenium ion moiety to sense positive charge development, is inadequate to represent this reaction: separate axes are required for carbon-oxygen bond cleavage and development of carbon-oxygen double-bond character.

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