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CS-W001157 4
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3-Morpholinobenzonitrile

  • CAS No. 204078-31-9

  • Cat. No. CS-0060408
  • Molecule weight188.23
  • Purity≥97%
  • MDL No.None

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

3-Morpholinobenzonitrile|CS-0060408

Structure of 204078-31-9

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General Information

  • CAS No. 204078-31-9
  • Cat. No. CS-0060408
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂N₂O
  • Molecular Weight 188.23
  • Synonym(s) 3-Morpholin-4-ylbenzonitrile
  • SMILES C1=CC(=CC(=C1)N2CCOCC2)C#N

Synthesis

  • Route1

    References

    • Lee, Jian-Cheng; Wang, Ming-Gin; Hong, Fung-E. European Journal of Inorganic Chemistry, 2005 , # 24 p. 5011 - 5017
  • Route2

    References

    • Reddy, Ch. Venkat; Kingston, Jesudoss V.; Verkade, John G. Journal of Organic Chemistry, 2008 , vol. 73, # 8 p. 3047 - 3062
  • Route3

    References

    • Kyowa Hakko Kogyo Co., Ltd. Patent: US6127541 A1, 2000 ; US 6127541 A

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   36.26
  • LogP   1.39488
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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