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CS-W001157 4
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(E)-N,N-dimethyl-2-(1-nitronaphthalen-2-yl)ethen-1-amine

  • CAS No. 176853-40-0

  • Cat. No. CS-0506300
  • Purity≥98%
  • MDL No.None

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

(E)-N,N-dimethyl-2-(1-nitronaphthalen-2-yl)ethen-1-amine|CS-0506300

Structure of 176853-40-0

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General Information

  • CAS No. 176853-40-0
  • Cat. No. CS-0506300
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₄N₂O₂
  • Molecular Weight 242.27
  • Synonym(s) (E)-N,N-dimethyl-2-(1-nitronaphthalen-2-yl)ethenamine
  • SMILES O=[N+](C1=C2C=CC=CC2=CC=C1/C=C/N(C)C)[O-]

Synthesis

  • Route1

    References

    • Riesgo, Elvira C.; Jin, Xiaoqing; Thummel, Randolph P. Journal of Organic Chemistry, 1996 , vol. 61, # 9 p. 3017 - 3022
  • Route2

    References

    • MERCK SHARP and DOHME CORP.; KUDUK, Scott, D.; CHANG, Ronald, K.; GRESHOCK, Thomas, J. Patent: WO2012/47702 A1, 2012 ; Location in patent: Page/Page column 32-33 ; WO 2012/047702 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   46.38
  • LogP   3.2803
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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