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2-isobutyl-p-benzoquinone, also known as 2-isobutyl-1,4-benzoquinone, is an organic compound with the chemical formula C10H12O2. It is a yellow crystalline solid that is soluble in organic solvents such as ethanol and acetone. This quinone derivative is characterized by a benzene ring with two carbonyl groups at the 1,4-positions and an isobutyl group attached to the 2-position. It is used in various chemical reactions and as an intermediate in the synthesis of pharmaceuticals and other organic compounds. Due to its reactivity, it is important to handle 2-isobutyl-p-benzoquinone with care, as it can be harmful if inhaled, ingested, or absorbed through the skin.

4197-79-9

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4197-79-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4197-79-9 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,1,9 and 7 respectively; the second part has 2 digits, 7 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 4197-79:
(6*4)+(5*1)+(4*9)+(3*7)+(2*7)+(1*9)=109
109 % 10 = 9
So 4197-79-9 is a valid CAS Registry Number.
InChI:InChI=1/C10H12O2/c1-7(2)5-8-6-9(11)3-4-10(8)12/h3-4,6-7H,5H2,1-2H3

4197-79-9SDS

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-isobutyl-p-benzoquinone

1.2 Other means of identification

Product number -
Other names 2-Isobutyl-p-benzoquinone

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:4197-79-9 SDS

4197-79-9Relevant academic research and scientific papers

Catalytic asymmetric [2+2] cycloaddition between quinones and fulvenes and a subsequent stereoselective isomerization to 2,3-dihydrobenzofurans

Zheng, Haifeng,Xu, Chaoran,Wang, Yan,Kang, Tengfei,Liu, Xiaohua,Lin, Lili,Feng, Xiaoming

supporting information, p. 6585 - 6588 (2017/07/10)

The catalytic enantioselective [2+2] cycloaddition between quinones and fulvenes was achieved, for the first time, by the use of a chiral copper(ii) complex catalyst. The transformation afforded a series of enantiomerically enriched [6,4,5]-tricyclic cyclobutane derivatives in good yields with excellent regio- and stereoselectivities. Furthermore, the [2+2] adducts could be easily converted into formal [3+2] adducts efficiently and stereoselectively.

Chiral cobalt(II) complex catalyzed Friedel-Crafts aromatization for the synthesis of axially chiral biaryldiols

Xu, Chaoran,Zheng, Haifeng,Hu, Bowen,Liu, Xiaohua,Lin, Lili,Feng, Xiaoming

supporting information, p. 9741 - 9744 (2017/09/07)

An efficient atroposelective synthesis of axially chiral biaryldiols via asymmetric Friedel-Crafts aromatization between p-quinones and 2-naphthols was developed. A chiral cobalt(ii) complex of N,N′-dioxide enabled the process to generate axially chiral biaryldiols in up to 98% yield and 95% ee. A large range of substituents at different positions of p-quinones and 2-naphthols was tolerable. The configuration of the product and the chiral N,N′-dioxide-Co(ClO4)2 catalyst was identified by X-ray crystal diffraction analysis and a possible catalytic model was suggested.

Substituent effects in the oxidation of 2-alkyl-1,4-dialkoxybenzenes with ceric ammonium nitrate

Love, Brian E.,Simmons, Alexander L.

, p. 5712 - 5715 (2016/11/29)

Increased steric size of alkyl groups and the presence of coordinating atoms on alkoxy groups have both been found to contribute to decreasing yields of diquinones upon reaction of 2-alkyl-1,4-dialkoxybenzenes with CAN. The overall hydrophilicity of the substrates does not appear to be a significant factor in determining the diquinone yield for these reactions.

Effects of reaction conditions on quinone/diquinone product ratios in the oxidation of 1,4-dimethoxybenzene derivatives with ceric ammonium nitrate

Love, Brian E.,Duffy, Brian C.,Simmons, Alexander L.

supporting information, p. 1994 - 1997 (2014/04/03)

Proper choice of reaction conditions allows formation of either the quinone or corresponding diquinone as the major product upon treatment of 2-alkyl-1,4-dimethoxybenzenes with ceric ammonium nitrate.

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