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CS-W001157 4
Total: USD 88.00

1-Nitrooctane

  • CAS No. 629-37-8

  • Cat. No. CS-0525115
  • Purity≥98%
  • MDL No.None

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

1-Nitrooctane|CS-0525115

Structure of 629-37-8

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General Information

  • CAS No. 629-37-8
  • Cat. No. CS-0525115
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₇NO₂
  • Molecular Weight 159.23
  • Synonym(s) None
  • SMILES CCCCCCCC[N+]([O-])=O

Synthesis

  • Route1

    References

    • ANGUS CHEMICAL COMPANY; DOW GLOBAL TECHNOLOGIES INC. Patent: WO2009/129097 A1, 2009 ; Location in patent: Page/Page column 32 ;
  • Route2

    References

    • McNulty, James; Nair, Jerald J.; Cheekoori, Sreedhar; Larichev, Vladimir; Capretta, Alfredo; Robertson Chemistry - A European Journal, 2006 , vol. 12, # 36 p. 9314 - 9322
  • Route3

    References

    • Irfan, Muhammad; Glasnov, Toma N.; Kappe, C. Oliver Organic Letters, 2011 , vol. 13, # 5 p. 984 - 987

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   2.6236
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   7

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