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CS-W001157 4
Total: USD 88.00

1-(Heptyloxy)-4-nitrobenzene

  • CAS No. 13565-36-1

  • Cat. No. CS-0445430
  • Purity≥98%
  • MDL No.None

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

1-(Heptyloxy)-4-nitrobenzene|CS-0445430

Structure of 13565-36-1

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General Information

  • CAS No. 13565-36-1
  • Cat. No. CS-0445430
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₉NO₃
  • Molecular Weight 237.29
  • Synonym(s) p-Nitrophenyl heptyl ether
  • SMILES CCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Park, Joo-Hoon; Choi, Ok-Byung; Lee, Hwan Myung; Lee, Jin-Young; Kim, Sung-Jo; Cha, Eun-Hee; Kim, Dong-Hyun; Ramaraj; So, Bong-Keun; Kim, Kyung-Hwan; Lee, Soo-Min; Yoon, Kuk Ro Bulletin of the Korean Chemical Society, 2012 , vol. 33, # 5 p. 1647 - 1652
  • Route2
    • null|null
      636-98-6
    • In-stock
      1-Heptanol|CS-0152146
      111-70-6
    • ~63%
    • 1-(Heptyloxy)-4-nitrobenzene|CS-0445430
      13565-36-1
    • 4-(Heptyloxy)aniline|CS-0317891
      39905-44-7

    References

    • Manbeck, Gerald F.; Lipman, Adam J.; Stockland Jr., Robert A.; Freidl, Adrienne L.; Hasler, Amy F.; Stone, Joshua J.; Guzei, Ilia A. Journal of Organic Chemistry, 2005 , vol. 70, # 1 p. 244 - 250
  • Route3

    References

    • Helburn; Bartoli; Pohaku; Maxka; Compton; Creedon; Stimpson Journal of Physical Organic Chemistry, 2007 , vol. 20, # 5 p. 321 - 331

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335-H351-H361
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   3.944
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   8

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