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CS-W001157 4
Total: USD 88.00

2-(Trifluoromethyl)phenol

  • CAS No. 444-30-4

  • Cat. No. CS-W016125
  • Purity≥98%
  • MDL No.MFCD00002222

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

2-(Trifluoromethyl)phenol|CS-W016125

Structure of 444-30-4

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General Information

  • CAS No. 444-30-4
  • Cat. No. CS-W016125
  • Purity ≥98%
  • MDL No. MFCD00002222
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅F₃O
  • Molecular Weight 162.11
  • Synonym(s) α,α,α-Trifluoro-o-cresol
  • SMILES C1=CC=CC(=C1C(F)(F)F)O

Description

2-Hydroxybenzotrifluoride was used to investigate the self-aggregation of polyanion-containing cinnamoyl group with diazoresin (DR) to form stable covalent ultrathin film by UV irradiation.

Application

2-(Trifluoromethyl)phenol serves as a valuable building block in medicinal chemistry and agrochemical synthesis, offering enhanced metabolic stability and lipophilicity through its trifluoromethyl group. The phenolic functionality enables direct coupling reactions, electrophilic substitutions, and derivatization under standard conditions. Its bench-stable nature and compatibility with common protecting group strategies facilitate integration into complex molecular architectures.

Synthesis

  • Route1

    References

    • Sergeev, Alexey G.; Schulz, Thomas; Torborg, Christian; Spannenberg, Anke; Neumann, Helfried; Beller, Matthias Angewandte Chemie, International Edition, 2009 , vol. 48, # 41 p. 7595 - 7599
  • Route2

    References

    • Xu, Jun; Luo, Dong-Fen; Xiao, Bin; Liu, Zhao-Jing; Gong, Tian-Jun; Fu, Yao; Liu, Lei Chemical Communications, 2011 , vol. 47, # 14 p. 4300 - 4302
  • Route3

    References

    • Chen, Junmin; Yuan, Tangjun; Hao, Wenyan; Cai, Mingzhong Catalysis Communications, 2011 , vol. 12, # 15 p. 1463 - 1465

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS05,GHS07
Signal Word : Danger
UN#: 1325
Class : 4.1
Packing Group : Ⅱ
Hazard Statements : H228-H302+H312+H332-H315-H318-H335
Precautionary Statements : P210-P240-P241-P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P370+P378-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.411
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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