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CS-W001157 4
Total: USD 88.00

Isoamylbenzene

  • CAS No. 2049-94-7

  • Cat. No. CS-0204895
  • Purity≥95%
  • MDL No.MFCD00008948

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

Isoamylbenzene|CS-0204895

Structure of 2049-94-7

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General Information

  • CAS No. 2049-94-7
  • Cat. No. CS-0204895
  • Purity ≥95%
  • MDL No. MFCD00008948
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆
  • Molecular Weight 148.24
  • Synonym(s) Isopentylbenzene
  • SMILES C=1C=CC(=CC1)CCC(C)C

Synthesis

  • Route1
    • null|null
      29443-54-7
    • null|null
      1068-55-9
    • ~92%
    • Isoamylbenzene|CS-0204895
      2049-94-7

    References

    • Hoffmann, Reinhard W.; Knopff, Oliver; Kusche, Andreas Angewandte Chemie - International Edition, 2000 , vol. 39, # 8 p. 1462 - 1464
  • Route2
    • null|null
      19031-66-4
    • ~83%
    • Isoamylbenzene|CS-0204895
      2049-94-7

    References

    • Hirano, Koji; Fujita, Kazuya; Yorimitsu, Hideki; Shinokubo, Hiroshi; Oshima, Koichiro Tetrahedron Letters, 2004 , vol. 45, # 12 p. 2555 - 2557
  • Route3
    • null|null
      74312-51-9
    • ~22%
    • (3-Methylbut-2-en-1-yl)benzene|CS-0243747
      4489-84-3
    • null|null
      6683-51-8
    • Isoamylbenzene|CS-0204895
      2049-94-7

    References

    • Journal of Organic Chemistry, , vol. 45, # 24 p. 4926 - 4931

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H302
Precautionary Statements : P210-P264-P270-P280-P330-P370+P378-P403-P501

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.2752
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   3

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