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CS-W001157 4
Total: USD 88.00

Pentan-3-ylbenzene

  • CAS No. 1196-58-3

  • Cat. No. CS-0335049
  • Molecule weight148.24
  • Purity≥98%
  • MDL No.MFCD00048663

*For research and further manufacturing use only, not for direct human use.

Pentan-3-ylbenzene|CS-0335049

Structure of 1196-58-3

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General Information

  • CAS No. 1196-58-3
  • Cat. No. CS-0335049
  • Purity ≥98%
  • MDL No. MFCD00048663
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆
  • Molecular Weight 148.24
  • Synonym(s) 3-Phenylpentane
  • SMILES CCC(CC)C1=CC=CC=C1

Synthesis

  • Route1
    • null|null
      54509-73-8
    • null|null
      108-88-3
    • ~67%
    • Pentan-3-ylbenzene|CS-0335049
      1196-58-3

    References

    • Steele, Barry R.; Screttas, Constantinos G. Journal of the American Chemical Society, 2000 , vol. 122, # 10 p. 2391 - 2392
  • Route2
    • null|null
      54509-73-8
    • null|null
      108-88-3
    • ~18%
    • null|null
      103-65-1
    • In-stock
      Pentylbenzene|CS-0128379
      538-68-1
    • Pentan-3-ylbenzene|CS-0335049
      1196-58-3

    References

    • Rummel; Yunusov; Kalyuzhnaya; Shur Journal of Organometallic Chemistry, 2009 , vol. 694, # 9-10 p. 1467 - 1472
  • Route3
    • null|null
      110-53-2
    • null|null
      71-43-2
    • ~%
    • In-stock
      Pentylbenzene|CS-0128379
      538-68-1
    • 1-Phenyl-1-methylbutane|CS-0450406
      2719-52-0
    • Pentan-3-ylbenzene|CS-0335049
      1196-58-3

    References

    • Zupp, Laurine R.; Campanella, Veronica L.; Rudzinski, Diandra M.; Beland, Franois; Priefer, Ronny Tetrahedron Letters, 2012 , vol. 53, # 39 p. 5343 - 5346

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P301+P310-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.5902
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   3

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