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CS-W001157 4
Total: USD 88.00

3-Ethyl-4-(hydroxymethyl)benzonitrile

  • CAS No. 202522-03-0

  • Cat. No. CS-0200282
  • Molecule weight161.20
  • Purity≥97%
  • MDL No.MFCD18910890

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

3-Ethyl-4-(hydroxymethyl)benzonitrile|CS-0200282

Structure of 202522-03-0

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General Information

  • CAS No. 202522-03-0
  • Cat. No. CS-0200282
  • Purity ≥97%
  • MDL No. MFCD18910890
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO
  • Molecular Weight 161.20
  • Synonym(s) None
  • SMILES N#CC1=CC=C(CO)C(CC)=C1

Synthesis

  • Route1
    • 3-Ethyl-4-formylbenzonitrile|CS-0200281
      202522-04-1
    • ~75%
    • 3-Ethyl-4-(hydroxymethyl)benzonitrile|CS-0200282
      202522-03-0

    References

    • Journal of Medicinal Chemistry, , vol. 43, # 6 p. 1203 - 1214

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-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   44.02
  • LogP   1.61298
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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