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CS-W001157 4
Total: USD 88.00

2-(4-Butoxyphenyl)acetonitrile

  • CAS No. 38746-93-9

  • Cat. No. CS-0364577
  • Molecule weight189.25
  • Purity≥98%
  • MDL No.None

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

2-(4-Butoxyphenyl)acetonitrile|CS-0364577

Structure of 38746-93-9

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General Information

  • CAS No. 38746-93-9
  • Cat. No. CS-0364577
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅NO
  • Molecular Weight 189.25
  • Synonym(s) 4-Butoxyphenylacetonitrile
  • SMILES CCCCOC1=CC=C(C=C1)CC#N

Synthesis

  • Route1

    References

    • KABUSHIKI KAISHA YAKULT HONSHA Patent: EP1591117 A1, 2005 ; Location in patent: Page/Page column 15-16 ;
  • Route2

    References

    • Lisowski, Vincent; Enguehard, Cecile; Lancelot, Jean-Charles; Caignard, Daniel-Henri; Lambel, Stephanie; Leonce, Stephane; Pierre, Alain; Atassi, Ghanem; Renard, Pierre; Rault, Sylvain Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 16 p. 2205 - 2208
  • Route3

    References

    • Lisowski, Vincent; Enguehard, Cecile; Lancelot, Jean-Charles; Caignard, Daniel-Henri; Lambel, Stephanie; Leonce, Stephane; Pierre, Alain; Atassi, Ghanem; Renard, Pierre; Rault, Sylvain Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 16 p. 2205 - 2208

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   2.93158
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   5

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