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CS-W001157 4
Total: USD 88.00

tert-Butyl(4-cyanophenethyl)carbamate

  • CAS No. 172348-86-6

  • Cat. No. CS-0171920
  • Purity≥97%
  • MDL No.MFCD10687163

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

tert-Butyl(4-cyanophenethyl)carbamate|CS-0171920

Structure of 172348-86-6

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General Information

  • CAS No. 172348-86-6
  • Cat. No. CS-0171920
  • Purity ≥97%
  • MDL No. MFCD10687163
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₈N₂O₂
  • Molecular Weight 246.30
  • Synonym(s) tert-Butyl 4-cyanophenethylcarbamate
  • SMILES CC(C)(OC(NCCC1=CC=C(C#N)C=C1)=O)C

Synthesis

  • Route1

    References

    • GRUeNENTHAL GMBH; MERLA, Beatrix; OBERBOeRSCH, Stefan; REICH, Melanie; SCHUNK, Stefan; JOSTOCK, Ruth; HEES, Sabine; ENGELS, Michael; GERMANN, Tieno; BIJSTERVELD, Edward Patent: WO2010/99938 A1, 2010 ; Location in patent: Page/Page column 118-119 ;
  • Route2
    • null|null
      177736-05-9
    • ~76%
    • tert-Butyl(4-cyanophenethyl)carbamate|CS-0171920
      172348-86-6

    References

    • LABORATORIOS MENARINI S.A. Patent: EP775133 B1, 2001 ;
  • Route3
    • null|null
      7150-72-3
    • ~%
    • tert-Butyl(4-cyanophenethyl)carbamate|CS-0171920
      172348-86-6

    References

    • Molander, Gary A.; Vargas, Fabricio Organic Letters, 2007 , vol. 9, # 2 p. 203 - 206

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   62.12
  • LogP   2.62548
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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