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CS-W001157 4
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1-Methylcyclohexane-1-carbonitrile

  • CAS No. 62718-34-7

  • Cat. No. CS-0230953
  • Molecule weight123.20
  • Purity≥97%
  • MDL No.None

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

1-Methylcyclohexane-1-carbonitrile|CS-0230953

Structure of 62718-34-7

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General Information

  • CAS No. 62718-34-7
  • Cat. No. CS-0230953
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₃N
  • Molecular Weight 123.20
  • Synonym(s) 1-METHYLCYCLOHEXANECARBONITRILE
  • SMILES CC1(CCCCC1)C#N

Synthesis

  • Route1
    • null|null
      590-67-0
    • null|null
      143-33-9
    • ~77%
    • 1-Methylcyclohexane-1-carbonitrile|CS-0230953
      62718-34-7

    References

    • Davis, Roman; Untch, Karl G. Journal of Organic Chemistry, 1981 , vol. 46, # 14 p. 2985 - 2987
  • Route2

    References

    • Shimojo, Hiroyuki; Moriyama, Katsuhiko; Togo, Hideo Synthesis (Germany), 2013 , vol. 45, # 15 art. no. SS-2013-F0311-OP, p. 2155 - 2164
  • Route3
    • null|null
      86559-21-9
    • ~29%
    • 1-Methylcyclohexane-1-carbonitrile|CS-0230953
      62718-34-7

    References

    • Reetz, Manfred T.; Chatziiosifidis, Ioannis; Kuenzer, Hermann; Mueller-Starke, Hans Tetrahedron, 1983 , vol. 39, # 6 p. 961 - 966

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3276
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H312-H330-H410
Precautionary Statements : P264-P270-P330-P405-P501

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.48038
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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