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1,4-Benzenediol, 2-(2-methyl-1H-indol-3-yl)-, also known as 3-indolyl hydroquinone, is a derivative formed through the conjugate addition of a 2-methylindole to a p-benzoquinone. 1,4-Benzenediol, 2-(2-methyl-1H-indol-3-yl)- is synthesized under mild conditions using bismuth triflate catalysis, yielding high selectivity and excellent efficiency. Additionally, it serves as a key intermediate in enantioselective transformations, such as [3+2] cyclizations, to form complex benzofuroindoline scaffolds with high stereocontrol, which are valuable in pharmaceutical and biologically active compounds. The mild reaction conditions and broad substrate compatibility make 1,4-Benzenediol, 2-(2-methyl-1H-indol-3-yl)- a versatile building block in organic synthesis. Other names for 1,4-Benzenediol, 2-(2-methyl-1H-indol-3-yl)- may include: - 2-(2-Methyl-1H-indol-3-yl)benzene-1,4-diol - 3-(2-Methylindol-3-yl)hydroquinone - 2-(2-Methyl-1H-indol-3-yl)-1,4-benzenediol

80641-50-5

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80641-50-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 80641-50-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,0,6,4 and 1 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 80641-50:
(7*8)+(6*0)+(5*6)+(4*4)+(3*1)+(2*5)+(1*0)=115
115 % 10 = 5
So 80641-50-5 is a valid CAS Registry Number.

80641-50-5SDS

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 2-(2-methyl-1H-indol-3-yl)benzene-1,4-diol

1.2 Other means of identification

Product number -
Other names 2-(2-methyl-1H-indol-3-yl)-1,4-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:80641-50-5 SDS

80641-50-5Downstream Products

80641-50-5Relevant academic research and scientific papers

Bi(OTf)3-catalyzed conjugate addition of indoles to p-quinones: a facile synthesis of 3-indolyl quinones

Yadav, J. S.,Reddy, B. V. S.,Swamy, T.

, p. 9121 - 9124 (2003)

A wide range of indoles undergo conjugate addition to p-benzoquinones in the presence of 2 mol percent bismuth triflate under mild conditions to afford the corresponding 3-indolyl quinones in excellent yields with high selectivity.

Enantioselective synthesis of C3 substituted benzofuroindolines via catalytic asymmetric [3u202f+u202f2] cyclization of 3-substituted indoles with p-benzoquinones

Lan, Wei-qiao,Liao, Li-hua,Liu, Fang-yi,Lu, Zhen-yu,Wang, Jun-yi,Zhang, Xiao-mei

, (2021)

An efficient catalytic asymmetric [3 + 2] cyclization of 3-substituted indoles with p-benzoquinones has been realized using a binol-chiral phosphoric acid. A large variety of C3 substituted benzofuroindolines compounds were achieved in moderate to high yields (up to 91% yield) and excellent enantioselectivities (up to 94% ee).

Catalytic Asymmetric Dearomative [3+2] Cyclisation of 1,4-Quinone with 2,3-Disubstituted Indoles

Zhang, Lvye,Hu, Jinjin,Xu, Ruigang,Pan, Shulei,Zeng, Xiaofei,Zhong, Guofu

, p. 5449 - 5457 (2019)

A chiral phosphoric acid-catalysed asymmetric dearomative [3+2] cyclisation for accessing enantioenriched benzofuroindolines with two vicinal tetrasubstituted carbon centres from readily available 1,4-quinone and 2,3-disubstituted indoles is developed. This protocol distinguishes itself by availability of the starting materials and mild reaction conditions in a stereoselective manner, which provides a complement to the existing methods for the asymmetric construction of pharmaceutically and biologically active benzofuro[2,3-b]indoline compounds. (Figure presented.).

InBr3-Catalyzed Conjugate Addition of Indoles to p-Quinones: An Efficient Synthesis of 3-Indolylquinones

Yadav,Reddy,Swamy

, p. 106 - 110 (2007/10/03)

Indium(III) bromide catalyzes efficiently the conjugate addition of indoles to p-benzoquinones under mild conditions to afford the corresponding 3-indolylquinones in high yields with high selectivity. 1,4-Naphthoquinones also underwent Michael addition with indoles under similar conditions to give 3-indolylnaphthoquinones.

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