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CS-W001157 4
Total: USD 88.00

2-Methyloctanenitrile

  • CAS No. 2570-96-9

  • Cat. No. CS-0260222
  • Molecule weight139.24
  • Purity≥98%
  • MDL No.None

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

2-Methyloctanenitrile|CS-0260222

Structure of 2570-96-9

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General Information

  • CAS No. 2570-96-9
  • Cat. No. CS-0260222
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₇N
  • Molecular Weight 139.24
  • Synonym(s) Octanenitrile,2-methyl
  • SMILES CCCCCCC(C)C#N

Synthesis

  • Route1
    • null|null
      4128-31-8
    • null|null
      143-33-9
    • ~73%
    • 2-Methyloctanenitrile|CS-0260222
      2570-96-9

    References

    • Davis, Roman; Untch, Karl G. Journal of Organic Chemistry, 1981 , vol. 46, # 14 p. 2985 - 2987
  • Route2
    • null|null
      124243-27-2
    • ~75%
    • 2-Methyloctanenitrile|CS-0260222
      2570-96-9

    References

    • Okimoto; Chiba Journal of Organic Chemistry, 1990 , vol. 55, # 3 p. 1070 - 1076
  • Route3
    • null|null
      4128-31-8
    • null|null
      10442-39-4
    • ~89%
    • 2-Methyloctanenitrile|CS-0260222
      2570-96-9

    References

    • Iranpoor, Nasser; Firouzabadi, Habib; Akhlaghinia, Batool; Nowrouzi, Najmeh Journal of Organic Chemistry, 2004 , vol. 69, # 7 p. 2562 - 2564

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

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   3.11648
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   5

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