Cas no 116279-08-4 (3-Cyclopentylpropyne)

3-Cyclopentylpropyne structure
3-Cyclopentylpropyne structure
Product Name:3-Cyclopentylpropyne
CAS No:116279-08-4
MF:C8H12
MW:108.180882453918
MDL:MFCD00041559
CID:91458
PubChem ID:521007
Update Time:2025-04-18

3-Cyclopentylpropyne Chemical and Physical Properties

Names and Identifiers

    • 3-CYCLOPENTYL-1-PROPYNE
    • (2-propynyl)cyclopentane
    • cyclopentane,2-propynyl-
    • TIMTEC-BB SBB008891
    • prop-2-ynylcyclopentane
    • 2-propynylcyclopentane
    • 3-CYCLOPENTYL-1-PROPYNE 98%
    • 3-Cyclopentyl-1-propyne, 98+%
    • CS-0230395
    • DTXSID60334530
    • EN300-103716
    • FT-0615575
    • J-003416
    • Prop-2-ynyl-cyclopentane
    • 116279-08-4
    • MFCD00041559
    • 3-Cyclopentyl-1-propyne, 97%
    • Cyclopentylpropyne
    • 3-cyclopentylpropyne
    • AKOS015916730
    • 2-Propynylcyclopentane #
    • (Prop-2-yn-1-yl)cyclopentane
    • prop-2-yn-1-ylcyclopentane
    • G39400
    • 3-Cyclopentylpropyne
    • MDL: MFCD00041559
    • Inchi: 1S/C8H12/c1-2-5-8-6-3-4-7-8/h1,8H,3-7H2
    • InChI Key: VBTCAHMANZTRMG-UHFFFAOYSA-N
    • SMILES: C1(CC#C)CCCC1
    • BRN: 2424582

Computed Properties

  • Exact Mass: 108.09400
  • Monoisotopic Mass: 108.093900383g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 98.5
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Color/Form: Colorless or yellow liquid
  • Density: 0.827?g/mL?at 25?°C(lit.)
  • Melting Point: 132-134 °C
  • Boiling Point: 132-134?°C(lit.)
  • Flash Point: Fahrenheit: 69.8 ° f
    Celsius: 21 ° c
  • Refractive Index: n20/D 1.4490(lit.)
  • Solubility: Not miscible or difficult to mix.
  • PSA: 0.00000
  • LogP: 2.19990
  • Solubility: Insoluble in water

3-Cyclopentylpropyne Security Information

  • Symbol: GHS02 GHS05 GHS07
  • Signal Word:Danger
  • Hazard Statement: H225-H302-H318
  • Warning Statement: P210-P280-P305+P351+P338
  • Hazardous Material transportation number:UN 1993 3/PG 3
  • WGK Germany:2
  • Hazard Category Code: 10-22-41
  • Safety Instruction: S16
  • Hazardous Material Identification: Xn
  • HazardClass:3
  • PackingGroup:II
  • Packing Group:II
  • Risk Phrases:R10
  • Safety Term:S16-26-36/39
  • Packing Group:II

3-Cyclopentylpropyne Pricemore >>

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