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CS-W001157 4
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4-(Trifluoromethyl)benzene-1,2-diamine

  • CAS No. 368-71-8

  • Cat. No. CS-W007576
  • Purity≥98%
  • MDL No.MFCD00042456

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

4-(Trifluoromethyl)benzene-1,2-diamine|CS-W007576

Structure of 368-71-8

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General Information

  • CAS No. 368-71-8
  • Cat. No. CS-W007576
  • Purity ≥98%
  • MDL No. MFCD00042456
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇F₃N₂
  • Molecular Weight 176.14
  • Synonym(s) Dimethyl 2-Bromo-3-Fluorobutanedioate
  • SMILES NC1=CC=C(C(F)(F)F)C=C1N

Description

Dimethyl decanedioate can be used as plasticizer, softener and solvent for cellulose resin, vinyl resin and synthetic rubber. It is widely used as the main raw material for the production of light stabilizers UV-770, UV-765, UV-123, etc. It is used as a solvent and plasticizer for cellulose and vinyl resins, and as an intermediate in organic synthesis.

Application

4-(Trifluoromethyl)benzene-1,2-diamine serves as a valuable building block in medicinal chemistry and materials science, enabling the synthesis of functionalized heterocycles and bioactive scaffolds. Its ortho-diamine motif facilitates efficient cyclization reactions, while the electron-withdrawing trifluoromethyl group enhances metabolic stability and modulates electronic properties. The compound exhibits good bench stability and compatibility with common protecting group strategies, supporting versatile downstream transformations in multi-step syntheses.

Synthesis

  • Route1

    References

    • Takano, Yasuo; Shiga, Futoshi; Asano, Jun; Hori, Wataru; Fukuchi, Kazunori; Anraku, Tsuyoshi; Uno, Takashi Bioorganic and Medicinal Chemistry, 2006 , vol. 14, # 3 p. 776 - 792
  • Route2
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    • In-stock
      4-(Trifluoromethyl)benzene-1,2-diamine|CS-W007576
      368-71-8

    References

    • Keana; Kher; Sui Xiong Cai; Dinsmore; Glenn; Guastella; Huang; Ilyin; Lu; Mouser; Woodward; Weber Journal of Medicinal Chemistry, 1995 , vol. 38, # 22 p. 4367 - 4379
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      7732-18-5
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      4-(Trifluoromethyl)benzene-1,2-diamine|CS-W007576
      368-71-8

    References

    • The State of Oregon, acting by and through The Oregon State Board of Higher Education, acting for and on behalf of The Oregon Health Sciences University; The University of Oregon; The Regents of the University of California Patent: US5514680 A1, 1996 ; US 5514680 A

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   52.04
  • LogP   1.8698
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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