Cas no 300-68-5 (Pyrrolidine,1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride (9CI))

Pyrrolidine,1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride (9CI) structure
300-68-5 structure
Product Name:Pyrrolidine,1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride (9CI)
CAS No:300-68-5
MF:C12H22Cl2N2
MW:265.222481250763
CID:307936
PubChem ID:71074
Update Time:2025-04-19

Pyrrolidine,1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride (9CI) Chemical and Physical Properties

Names and Identifiers

    • Pyrrolidine,1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride (9CI)
    • 1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidine,dihydrochloride
    • 1,1'-but-2-yne-1,4-diyldipyrrolidine dihydrochloride
    • 1,1-but-2-ynylenedipyrrolidinium dichloride
    • SR-01000872650-1
    • SR-01000872650
    • Pyrrolidine, 1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride
    • Prestwick_479
    • 1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidine;dihydrochloride
    • HMS1569C03
    • CCG-220331
    • EINECS 206-097-8
    • 1,4-Dipyrrolidino-2-butyne dihydrochloride
    • 1,1'-But-2-ynylenedipyrrolidinium dichloride
    • DTXSID10184082
    • Tremorine dihydrochloride
    • SCHEMBL3757253
    • Tremorine HCl
    • 1,1'-(2-Butynylene)dipyrrolidine dihydrochloride
    • 300-68-5
    • Pyrrolidine, 1,1'-(2-butynylene)di-, dihydrochloride
    • Tremorine dichlorohydrate
    • 1-[4-(1-pyrrolidinyl)-2-butynyl]pyrrolidine dihydrochloride
    • Inchi: 1S/C12H20N2.2ClH/c1-2-8-13(7-1)11-5-6-12-14-9-3-4-10-14;;/h1-4,7-12H2;2*1H
    • InChI Key: ASHYBFCDTYPECZ-UHFFFAOYSA-N
    • SMILES: Cl.Cl.N1(CC#CCN2CCCC2)CCCC1

Computed Properties

  • Exact Mass: 264.11626
  • Monoisotopic Mass: 264.1160041g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 201
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 6.5?2

Experimental Properties

  • PSA: 6.48

Pyrrolidine,1,1'-(2-butyne-1,4-diyl)bis-, dihydrochloride (9CI) Security Information

  • Hazardous Material transportation number:2811
  • Hazard Category Code: 20/21/22
  • Safety Instruction: 36
  • Hazardous Material Identification: Xn
  • HazardClass:6.1(b)
  • PackingGroup:III
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