Cas no 6165-76-0 (Propargyl Tosylate)

Propargyl Tosylate is a versatile organic compound characterized by its tosylate (p-toluenesulfonate) and propargyl functional groups. It serves as a valuable reagent in organic synthesis, particularly in nucleophilic substitution and cross-coupling reactions, owing to its reactive propargyl moiety. The tosylate group enhances its stability and solubility, facilitating handling in various reaction conditions. This compound is commonly employed in the preparation of alkynes, heterocycles, and other advanced intermediates in pharmaceutical and materials chemistry. Its well-defined reactivity profile and compatibility with diverse catalysts make it a practical choice for constructing complex molecular architectures. Propargyl Tosylate is typically handled under inert conditions to preserve its integrity.
Propargyl Tosylate structure
Propargyl Tosylate structure
Product Name:Propargyl Tosylate
CAS No:6165-76-0
MF:C10H10O3S
MW:210.249601840973
MDL:MFCD01462194
CID:46469
PubChem ID:87577217
Update Time:2025-06-06

Propargyl Tosylate Chemical and Physical Properties

Names and Identifiers

    • Prop-2-yn-1-yl 4-methylbenzenesulfonate
    • Propargyl p-toluenesulfonate
    • Propargyl Tosylate
    • p-Toluenesulfonic acid, 2-propynyl ester
    • prop-2-ynyl 4-methylbenzenesulfonate
    • p-Toluenesulfonic Acid Propargyl Ester
    • 2-Propyn-1-ol,4-methylbenzenesulfonate (9CI)
    • 2-Propyn-1-ol, p-toluenesulfonate(6CI,7CI,8CI)
    • 1-[(p-Toluenesulfonyl)oxy]-2-propyne
    • 2-Propynylp-toluenesulfonate
    • 2-Propynyl tosylate
    • Propargyl alcohol tosylate
    • Propargyltosylate
    • 2-Propyn-1-ol, 4-methylbenzenesulfonate
    • Propargyl p-toluene sulfonate
    • LMBVCSFXFFROTA-UHFFFAOYSA-N
    • Propargylp-toluenesulfonate
    • Propargyl p-toluenesulphonate
    • 4-11-00-00263 (Beilstein Handbook Reference)
    • T1455
    • 2-propynyl p-toluenesulfonate
    • BRN 1912957
    • AC-7059
    • 2-Propynyl 4-methylbenzenesulfonate #
    • UNII-XBC3GGJ44A
    • 6165-76-0
    • SCHEMBL1117279
    • AS-19271
    • AB10387
    • CS-W015112
    • MFCD01462194
    • AKOS015840418
    • SY025680
    • XBC3GGJ44A
    • NS00123213
    • Propargyl p-toluenesulfonate, >=97.0% (GC)
    • 1-((P-TOLUENESULFONYL)OXY)-2-PROPYNE
    • EN300-5034481
    • DTXSID80210665
    • A852321
    • prop-2-yn-1-yl 4-methylbenzene-1-sulfonate
    • CCRIS 9146
    • MDL: MFCD01462194
    • Inchi: 1S/C10H10O3S/c1-3-8-13-14(11,12)10-6-4-9(2)5-7-10/h1,4-7H,8H2,2H3
    • InChI Key: LMBVCSFXFFROTA-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(C)=CC=1)(=O)(=O)OCC#C
    • BRN: 1912957

Computed Properties

  • Exact Mass: 210.03500
  • Monoisotopic Mass: 210.03506535g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 309
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 51.8
  • Surface Charge: 0
  • XLogP3: 1.7

Experimental Properties

  • Color/Form: Powder
  • Density: 1.215?g/mL?at 20?°C(lit.)
  • Boiling Point: 344°C at 760 mmHg
  • Flash Point: Fahrenheit: 212 ° f
    Celsius: 100 ° c
  • Refractive Index: n20/D 1.530
  • Water Partition Coefficient: Soluble in Chloroform, Dichloromethane, DMSO, Ethyl Acetate. Not miscible in water.
  • PSA: 51.75000
  • LogP: 2.41430
  • Solubility: Not determined

Propargyl Tosylate Security Information

  • Symbol: GHS07
  • Prompt:warning
  • Signal Word:Warning
  • Hazard Statement: H315,H319,H335
  • Warning Statement: P261,P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26-S37/39
  • FLUKA BRAND F CODES:4.10-10-21
  • RTECS:XT7300000
  • Hazardous Material Identification: Xn
  • Storage Condition:2-8°C
  • Risk Phrases:R22; R36/37/38

Propargyl Tosylate Customs Data

  • HS CODE:2905290000
  • Customs Data:

    China Customs Code:

    2905290000

    Overview:

    2905290000 Other unsaturated monohydric alcohols.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, packing

    Summary:

    2905290000 unsaturated monohydric alcohols.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

Propargyl Tosylate Pricemore >>

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Propargyl Tosylate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:6165-76-0)Propargyl Tosylate
Order Number:A852321
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 07:39
Price ($):338.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:6165-76-0)Propargyl Tosylate
A852321
Purity:99%
Quantity:100g
Price ($):338.0
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