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CS-W001157 4
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4-[2-(diethylamino)ethoxy]benzonitrile

  • CAS No. 49773-11-7

  • Cat. No. CS-0244624
  • Molecule weight218.29
  • Purity≥97%
  • MDL No.None

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

4-[2-(diethylamino)ethoxy]benzonitrile|CS-0244624

Structure of 49773-11-7

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General Information

  • CAS No. 49773-11-7
  • Cat. No. CS-0244624
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈N₂O
  • Molecular Weight 218.29
  • Synonym(s) None
  • SMILES N#CC1=CC=C(OCCN(CC)CC)C=C1

Synthesis

  • Route1
    • null|null
      869-24-9
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • ~74%
    • 4-[2-(diethylamino)ethoxy]benzonitrile|CS-0244624
      49773-11-7

    References

    • Hoffmann-La Roche Inc. Patent: US6150373 A1, 2000 ; US 6150373 A
  • Route2
    • 4-Cyanophenol Febuxostat Impurity|CS-0213981
      767-00-0
    • null|null
      100-35-6
    • ~%
    • 4-[2-(diethylamino)ethoxy]benzonitrile|CS-0244624
      49773-11-7

    References

    • Yurugi; Miyake; Fushimi; et al. Chemical and Pharmaceutical Bulletin, 1973 , vol. 21, # 8 p. 1641 - 1650

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H312-H314-H332-H335
Precautionary Statements : P260-P264-P270-P271-P280-P301+P330+P331-P302+P352-P303+P361+P353-P304+P340-P305+P351+P338-P363-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   36.26
  • LogP   2.27888
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   6

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