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CS-W001157 4
Total: USD 88.00

Cyclohex-3-enecarbonitrile

  • CAS No. 100-45-8

  • Cat. No. CS-W011289
  • Molecule weight107.16
  • Purity≥95%
  • MDL No.MFCD00013778

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

Cyclohex-3-enecarbonitrile|CS-W011289

Structure of 100-45-8

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General Information

  • CAS No. 100-45-8
  • Cat. No. CS-W011289
  • Purity ≥95%
  • MDL No. MFCD00013778
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉N
  • Molecular Weight 107.16
  • Synonym(s) 3-Cyclohexene-1-carbonitrile
  • SMILES N#CC1CC=CCC1

Synthesis

  • Route1
    • null|null
      100-50-5
    • ~96%
    • Cyclohex-3-enecarbonitrile|CS-W011289
      100-45-8

    References

    • Sridhar, Madabhushi; Reddy, Mallu Kishore Kumar; Sairam, Vangipuram Venkata; Raveendra, Jillella; Godala, Kondal Reddy; Narsaiah, Chinthala; Ramanaiah, Beeram China; Reddy, Cirandur Suresh Tetrahedron Letters, 2012 , vol. 53, # 27 p. 3421 - 3424
  • Route2
    • null|null
      57606-87-8
    • ~98%
    • Cyclohex-3-enecarbonitrile|CS-W011289
      100-45-8

    References

    • Sridhar, Madabhushi; Reddy, Mallu Kishore Kumar; Sairam, Vangipuram Venkata; Raveendra, Jillella; Godala, Kondal Reddy; Narsaiah, Chinthala; Ramanaiah, Beeram China; Reddy, Cirandur Suresh Tetrahedron Letters, 2012 , vol. 53, # 27 p. 3421 - 3424
  • Route3
    • null|null
      106-99-0
    • null|null
      107-13-1
    • ~87%
    • Cyclohex-3-enecarbonitrile|CS-W011289
      100-45-8

    References

    • Korzenski, Michael B.; Kolis, Joseph W. Tetrahedron Letters, 1997 , vol. 38, # 32 p. 5611 - 5614

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3276
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H227-H302-H315-H319-H331
Precautionary Statements : P210-P261-P264-P270-P271-P280-P302+P352-P362+P364-P370+P378-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   1.86628
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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