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"Benzene, (1-propynylthio)-" is a chemical compound with the molecular formula C9H10S. It is an aromatic compound derived from benzene, with a 1-propynylthio group attached to it. This group consists of a propyne chain (a three-carbon alkyne) with a sulfur atom attached to the terminal carbon. The compound is also known as 1-(phenylthio)prop-1-yne or 1-phenylsulfanylpropyne. It is a colorless liquid with a pungent odor and is used in the synthesis of various organic compounds, particularly in the pharmaceutical and chemical industries. Due to its reactivity and potential health risks, it is important to handle Benzene, (1-propynylthio)- with care and in accordance with safety guidelines.

6212-77-7

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6212-77-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 6212-77-7 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,2,1 and 2 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 6212-77:
(6*6)+(5*2)+(4*1)+(3*2)+(2*7)+(1*7)=77
77 % 10 = 7
So 6212-77-7 is a valid CAS Registry Number.

6212-77-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name prop-1-ynylsulfanylbenzene

1.2 Other means of identification

Product number -
Other names (1-Propynylsulfanyl)benzene

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:6212-77-7 SDS

6212-77-7Relevant academic research and scientific papers

Studies related to the total synthesis of the sesquiterpene core of the pyrrolobenzoxazine natural products CJ-12662 and CJ-12663

Commandeur, Ma?gorzata,Commandeur, Claude,Paolis, Michael De,Edmunds, Andrew J.F.,Maienfisch, Peter,Ghosez, Léon

, p. 3359 - 3362 (2009)

A highly effective procedure is reported to synthesize a substituted bicyclo[4.2.0]octenol derivative by regioselective cycloaddition of phenyl-1-propynyl sulfide with cyclohexenone followed by selective reduction of the ketone group and reductive elimina

Dehydrochlorination of 2-chloroprop-2-en-1-yl sulfides

Rozentsveig,Nikonova,Levanova,Korchevin

, p. 1264 - 1266 (2016/10/26)

Dehydrochlorination of 2-chloroprop-2-en-1-yl sulfides on heating with solid potassium hydroxide afforded the corresponding 1-(organylsulfanyl)propynes in moderate to high yields and minor isomeric allene derivatives, organylsulfanylpropadienes.

Divergent Reactivity of Thioalkynes in Lewis Acid Catalyzed Annulations with Donor–Acceptor Cyclopropanes

Racine, Sophie,Hegedüs, Bence,Scopelliti, Rosario,Waser, Jér?me

supporting information, p. 11997 - 12001 (2016/08/16)

Efficient methods for the convergent synthesis of (poly)cyclic scaffolds are urgently needed in synthetic and medicinal chemistry. Herein, we describe new annulation reactions of thioalkynes with phthalimide-substituted donor–acceptor cyclopropanes, which gave access to highly substituted cyclopentenes and polycyclic ring systems. With silyl-thioalkynes, the Lewis acid catalyzed [3+2] annulation reaction with donor–acceptor cyclopropanes took place to afford 1-thio-cyclopenten-3-amines. On the other hand, an unprecedented polycyclic compound was formed with alkyl-thioalkynes through a reaction pathway directly involving the phthalimide group. The two transformations proceeded in good yields and tolerated a large variety of functional groups.

Alkynylation of Thiols with Ethynylbenziodoxolone (EBX) Reagents: α- Or β- π-Addition?

Wodrich, Matthew D.,Caramenti, Paola,Waser, Jerome

, p. 60 - 63 (2016/01/12)

The alkynylation of thiols with EthynylBenziodoXolone (EBX) reagents is a fast and chemoselective method for the synthesis of thioalkynes. Combined experimental and computational studies are reported, which led to the identification of a new mechanism for

Mechanism and stereochemistry of domino reaction of 2,3-dichloroprop-1-ene with diphenyl dichalcogenides in the system hydrazine hydrate - KOH

Levanova,Vakhrina,Grabel'Nykh,Rozentsveig,Russavskaya,Albanov,Korchevin

, p. 1722 - 1727 (2015/05/20)

A new scheme of the domino reactions of diphenyl dichalcogenides with 2,3-dichloroprop-1-ene in the system hydrazine hydrate - KOH was suggested, which included nucleophilic substitution of the allylic chlorine atom in dichloropropene, dehydrochlorination of the product obtained with the formation of an allene derivative, addition of a nucleophile to the allene system, allene-acetylene rearrangement, addition of a nucleophile to the triple bond with the formation of a Z-adduct, isomerization of a 2,3-dichalcogenide product to Z-1,2-dichalcogenylprop-1-enes, and isomerization of Z-adducts to E-isomers. The most plausible mechanisms of individual steps, involving carbanions stabilized by the α-chalcogen atom, were considered.

Domino reaction of 2,3-dichloroprop-1-ene with diphenyl disulfide in the system hydrazine hydrate-potassium hydroxide

Levanova,Grabel'Nykh,Elaev,Russavskaya,Klyba,Albanov,Tarasova,Korchevin

, p. 1341 - 1344 (2013/09/23)

2,3-Dichloroprop-1-ene reacted with diphenyl disulfide in the system hydrazine hydrate-potassium hydroxide at 30-35 C to give three products: 2-chloro-3-phenylsulfanylprop-1-ene, 1-phenylsulfanylpropadiene, and 1-phenylsulfanylprop-1-yne. Variation of tem

Prototropic rearrangement of 2-propynyl(methyl)amino, 2-propynyloxy, and 2-propynylsulfanyl derivatives of hetarenes under conditions of phase-transfer catalysis: Mechanism and limitations

Rubina,Fleisher,Abele,Popelis,Lukevits

, p. 963 - 967 (2007/10/03)

2-Propynyl derivatives of N-methylaniline, phenol, benzenethiol, 2-pyridinethiol, 2-pyrimidinethiol, and 1,3-benzoxazole-2-thiol were synthesized. Under conditions of phase-transfer catalysis, phenyl 2-propynyl sulfide is converted into allenyl phenyl sul

Rearrangements of 2-Phenylthioethanols with Alkenyl, Alkynyl, Ester, and Other Functionalised Alkyl Substituents at the Migration Origin: Synthesis of γ-Phenylthiocrotonate Esters

Brownbridge, Peter,Hunt, Paul G.,Warren, Stuart

, p. 1695 - 1706 (2007/10/02)

The effects of functional groups near the migration origin in and PhS shifts are explored: an α-CO2R group prevents migration, α or β vinyl groups have only steric effects, alkynyl or CO2Et groups encourage rearrangement and provide routes to γ-phenylthio unsaturated esters and ketones.

PYROLYSIS OF α-ACYL,α-THIO PHOSPHORANES THIOACETYLENES

Braga, Antonio L.,Comasseto, Joao V.,Petragnani, Nicola

, p. 1111 - 1114 (2007/10/02)

Pyrolysis of α-acyl,α-thio phosphoranes affords thioacetylenes in a good yield.The thio acethylenes are precursors of terminal and alkyl disubstituted acetylenes.

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