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2-Ethynylbenzyl alcohol 97, also known as 2-Phenylethynylcarbinol, is a chemical compound that falls under the category of alcohols due to its hydroxyl functional group. It is a colorless liquid with the molecular formula C9H8O. This versatile compound is primarily utilized in the synthesis of pharmaceuticals, particularly in the production of anti-cancer drugs. Furthermore, it serves as a reactant in organic synthesis and is involved in the manufacturing of various chemicals. Its applications span across the pharmaceutical and chemical industries, often acting as a building block for further chemical reactions that lead to the synthesis of a wide range of compounds.

10602-08-1

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10602-08-1 Usage

Uses

Used in Pharmaceutical Industry:
2-Ethynylbenzyl alcohol 97 is used as a key intermediate in the synthesis of pharmaceuticals for its ability to facilitate the production of anti-cancer drugs. Its unique structural composition allows it to be a valuable building block in the development of novel therapeutic agents.
Used in Chemical Industry:
In the chemical industry, 2-Ethynylbenzyl alcohol 97 is used as a reactant in organic synthesis. Its versatility in chemical reactions makes it an essential component in the manufacturing process of a variety of chemicals, contributing to the creation of new compounds with diverse applications.

Check Digit Verification of cas no

The CAS Registry Mumber 10602-08-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,0,6,0 and 2 respectively; the second part has 2 digits, 0 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 10602-08:
(7*1)+(6*0)+(5*6)+(4*0)+(3*2)+(2*0)+(1*8)=51
51 % 10 = 1
So 10602-08-1 is a valid CAS Registry Number.
InChI:InChI=1/C9H8O/c1-2-8-5-3-4-6-9(8)7-10/h1,3-6,10H,7H2

10602-08-1 Well-known Company Product Price

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  • Aldrich

  • (520039)  2-Ethynylbenzylalcohol  95%

  • 10602-08-1

  • 520039-5G

  • 3,133.26CNY

  • Detail

10602-08-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name (2-Ethynylphenyl)methanol

1.2 Other means of identification

Product number -
Other names o-Ethynylbenzyl alcohol

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:10602-08-1 SDS

10602-08-1Relevant academic research and scientific papers

Synthesis and Properties of Functional Twisted Tolanes

Kozhemyakin, Yury,Kretzschmar, Andreas,Kr?mer, Maximilian,Rominger, Frank,Dreuw, Andreas,Bunz, Uwe H. F.

, p. 9908 - 9918 (2017)

The synthesis and optical properties of several novel fluorescent and/or phosphorescent bridged tolanes (tolanophanes) are reported and their optical and structural properties are investigated. Specifically, diiodinated and bisalkynylated tolanophanes were obtained, and characterized by spectroscopy and computational methods. They represent attractive building blocks for novel polymers and emissive solid-state materials.

Synthesis of Functionalised 3-Isochromanones by Silylcarbocyclisation/Desilylation Reactions

Albano, Gianluigi,Morelli, Martina,Aronica, Laura Antonella

, p. 3473 - 3480 (2017)

A new protocol for the synthesis of 3-isochromanone derivatives based on rhodium-promoted silylcarbocyclisation reactions of ethynylbenzyl alcohol with different arylsilanes is described. The structure of the isochromanone depends upon the reaction condit

Configurationally Stabilized Analogs of M. ulcerans Exotoxins Mycolactones A and B Reveal the Importance of Side Chain Geometry for Mycolactone Virulence

Gehringer, Matthias,M?der, Patrick,Gersbach, Philipp,Pfeiffer, Bernhard,Scherr, Nicole,Dangy, Jean-Pierre,Pluschke, Gerd,Altmann, Karl-Heinz

, p. 5853 - 5857 (2019)

Mycolactones A/B (1a/b) are exotoxins of Mycobacterium ulcerans that are the molecular cause of Buruli ulcer. 1a/b represent a rapidly equilibrating mixture of Z/E isomers about the C4′=C5′ double bond of the C5-side chain. Here, we describe the syntheses

Au(I)/(R)-BINOL-Ti(IV) concerted catalyzed asymmetric cascade cycloaddition reaction of arylalkynols

Wang, Hongkai,Zeng, Tianlong,Chang, Weixing,Liu, Lingyan,Li, Jing

supporting information, p. 3573 - 3577 (2021/05/31)

An efficient catalytic asymmetric cascade cycloaddition reaction of arylalkynols with dioxopyrrolidines was developed. This reaction was achieved using Au(I) and (R)-BINOL-Ti(IV) bimetallic catalysts and exclusively delivered a series of chiral oxo-bridged bicyclic benzooxacine compounds in up to 86% yield with 96% ee as well as >33:1 dr. Meanwhile, three new σ bonds and three new stereogenic centers were formed in a one-pot process.

Substituent-Controlled Divergent Cascade Cycloaddition Reactions of Chalcones and Arylalkynols: Access to Spiroketals and Oxa-Bridged Fused Heterocycles

Chang, Weixing,Kong, Jingyang,Li, Jing,Liu, Lingyan,Wang, Hongkai,Zeng, Tianlong

supporting information, p. 4024 - 4032 (2021/07/12)

Herein, we report substituent-controlled divergent cascade cycloaddition reactions of chalcones and arylalkynols in the presence of PtI2. Depending on the substituent on the chalcone, either spiroketals or oxa-bridged fused heterocycles could be obtained in the ranges of 86–97% and 87–95% yields under identical reaction conditions. Control experiments were carried out to elucidate the origin of the high chemoselectivity. These provide a method for the synthesis of a diverse array of structurally complex oxygen-containing heterocycles. (Figure presented.).

Synthesis of phthalan derivatives via a formal intramolecular 1,3-insertion of rhodium(II) azavinyl carbenes into O[sbnd]Si bond

Deng, Changchang,Duan, Shengguo,Jie, Yuchen,Luo, Huan,Xiang, Qiaoyi,Xu, Ze-Feng

, (2021/08/30)

The first formal intramolecular 1,3-insertion into O[sbnd]Si bond of rhodium(II) azavinyl carbene have been developed, and valuable phthalan derivatives could be synthesized efficiently. In addition, various functional groups could be introduced to the pr

Structural Basis for Genetic-Code Expansion with Bulky Lysine Derivatives by an Engineered Pyrrolysyl-tRNA Synthetase

Yanagisawa, Tatsuo,Kuratani, Mitsuo,Seki, Eiko,Hino, Nobumasa,Sakamoto, Kensaku,Yokoyama, Shigeyuki

, p. 936 - 13,949 (2019/07/17)

Yanagisawa et al. analyzed the Y306A/Y384F mutant of Methanosarcina mazei pyrrolysyl-tRNA synthetase (PylRS) with 17 non-natural, bulky oxycarbonyllysine derivatives for tRNAPyl aminoacylation and site-specific incorporation into proteins. Fourteen crystal structures of the amino acid-bound PylRS mutant revealed the structural bases of the binding. This information facilitates the structure-based design of novel amino acids. Pyrrolysyl-tRNA synthetase (PylRS) and tRNAPyl have been extensively used for genetic-code expansion. A Methanosarcina mazei PylRS mutant bearing the Y306A and Y384F mutations (PylRS(Y306A/Y384F)) encodes various bulky non-natural lysine derivatives by UAG. In this study, we examined how PylRS(Y306A/Y384F) recognizes many amino acids. Among 17 non-natural lysine derivatives, N?-(benzyloxycarbonyl)lysine (ZLys) and 10 ortho/meta/para-substituted ZLys derivatives were efficiently ligated to tRNAPyl and were incorporated into proteins by PylRS(Y306A/Y384F). We determined crystal structures of 14 non-natural lysine derivatives bound to the PylRS(Y306A/Y384F) catalytic fragment. The meta- and para-substituted ZLys derivatives are snugly accommodated in the productive mode. In contrast, ZLys and the unsubstituted or ortho-substituted ZLys derivatives exhibited an alternative binding mode in addition to the productive mode. PylRS(Y306A/Y384F) displayed a high aminoacylation rate for ZLys, indicating that the double-binding mode minimally affects aminoacylation. These precise substrate recognition mechanisms by PylRS(Y306A/Y384F) may facilitate the structure-based design of novel non-natural amino acids.

Palladium-Catalyzed Synthesis of 6H-Dibenzo[c,h]chromenes and 5,6-Dihydrobenzo[c]phenanthridines: Application to the Synthesis of Dibenzo[c,h]chromene-6-ones, Benzo[c]phenanthridines, and Arnottin I

Pramanik, Subhendu,Jash, Moumita,Mondal, Debasmita,Chowdhury, Chinmay

, p. 5223 - 5238 (2019/11/11)

6H-Dibenzo[c,h]chromenes and 5,6-dihydrobenzo[c]phenanthridines have been synthesized via Palladium (II)-catalyzed domino reactions of acetylenic substrates involving intramolecular trans-oxo/amino palladation onto the triple bond followed by nucleophilic

Copper Promoted Regio- and Stereoselective Aminochlorination of Alkynes and Alkenes with NFSI

Wang, Weilin,Liu, Lingyan,Chang, Weixing,Li, Jing

, p. 8542 - 8547 (2018/05/30)

A simple and rapid copper-promoted aminochlorination of unactivated alkynes and alkenes with N-fluorobenzenesulfonimide (NFSI) was developed. Two series of chloroenamines and chloroamines were obtained in good to high yields. The chlorinated enamines could be obtained in a single E configuration. This reaction involved a radical process and the CuCl2 acted as the Cl source and NFSI as the N source.

The Divergent Cascade Reactions of Arylalkynols with Homopropargylic Amines or Electron-Deficient Olefins: Access to the Spiro-Isobenzofuran- b-pyrroloquinolines or Bridged-Isobenzofuran Polycycles

Wang, Lun,Liu, Lingyan,Chang, Weixing,Li, Jing

supporting information, p. 7799 - 7813 (2018/06/18)

Two divergent cascade reactions of arylalkynols with homopropargylic amines or electron-deficient olefins were developed to synthesize the spiro-isobenzofuran-b-pyrroloquinolines or bridged-isobenzofuran heterocycles in good yields, respectively. One reaction actually involved intramolecular 5-endo-dig hydroamination cyclization-protonation of homopropargylic amines to give cycloiminium ions and intramolecular 5-exo-dig hydroalkoxylation cyclization of arylalkynols to generate isobenzofuran with exocyclic double bond, followed by the nontypical Povarov-type reaction in the presence of PtCl2/FeCl3 cocatalysts. The other underwent intramolecular hydroalkoxylation cycloisomerization of alkynols with the subsequent normal [4 + 2] cycoaddition with dienophiles. Herein, the arylalkynols acted as both "masked" electron-rich olefins and "masked" electron-rich dienes.

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