Product Name

  • Name

    2'-(TRIFLUOROMETHOXY)ACETANILIDE

  • EINECS
  • CAS No. 3832-55-1
  • Article Data4
  • CAS DataBase
  • Density 1.345 g/cm3
  • Solubility
  • Melting Point 68 ºC
  • Formula C9H8 F3NO2
  • Boiling Point 261.5 ºC at 760 mmHg
  • Molecular Weight 219.163
  • Flash Point 111.9 ºC
  • Transport Information
  • Appearance
  • Safety 26-36
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 3832-55-1 (2'-(TRIFLUOROMETHOXY)ACETANILIDE)
  • Hazard Symbols IrritantXi
  • Synonyms O-acetanisidide,a,a,a-trifluoro- (6CI,8CI);N-[2-(Trifluoromethoxy)phenyl]acetamide;ZINC00128900;AC1LCIER;Maybridge1_000149;MixCom1_000281;GNF-Pf-2421;2-(Trifluoromethoxy)acetanilide;CHEMBL601326;2'-(Trifluoromethoxy)acetanilide;MolPort-000-147-018;N1-[2-(Trifluoromethoxy)phenyl]acetamide;
  • PSA 38.33000
  • LogP 2.61660

Acetamide,N-[2-(trifluoromethoxy)phenyl]- Specification

The Acetamide,N-[2-(trifluoromethoxy)phenyl]- with CAS registry number of 3832-55-1 is also known as 2-(Trifluoromethoxy)acetanilide. The IUPAC name is N-[2-(Trifluoromethoxy)phenyl]acetamide. In addition, the formula is C9H8F3NO2 and the molecular weight is 219.16. Although this chemical is stable at normal temperature and pressure, it should be sealed in a ventilated and dry place without light.

Physical properties about Acetamide,N-[2-(trifluoromethoxy)phenyl]- are: (1)ACD/LogP: 2.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.02; (4)ACD/LogD (pH 7.4): 2.02; (5)ACD/BCF (pH 5.5): 20.03; (6)ACD/BCF (pH 7.4): 20.03; (7)ACD/KOC (pH 5.5): 297.41; (8)ACD/KOC (pH 7.4): 297.41; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54Å2; (13)Index of Refraction: 1.496; (14)Molar Refractivity: 47.66 cm3; (15)Molar Volume: 162.9 cm3; (16)Polarizability: 18.89×10-24cm3; (17)Surface Tension: 33.2 dyne/cm; (18)Density: 1.345 g/cm3; (19)Flash Point: 111.9 °C; (20)Enthalpy of Vaporization: 49.92 kJ/mol; (21)Boiling Point: 261.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0115 mmHg at 25 °C.

When you are using this chemical, please be cautious about it. It is chemical that may cause inflammation to the skin or other mucous membranes. Besides, it's irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing. What's more, in case of contact with eyes, rinse immediately with plenty of water and seek medical advice

You can still convert the following datas into molecular structure:
1. SMILES: FC(F)(F)Oc1ccccc1NC(=O)C
2. InChI: InChI=1/C9H8F3NO2/c1-6(14)13-7-4-2-3-5-8(7)15-9(10,11)12/h2-5H,1H3,(H,13,14)
3. InChIKey: KZBHIVIJYKKLHL-UHFFFAOYAR
4. Std. InChI: InChI=1S/C9H8F3NO2/c1-6(14)13-7-4-2-3-5-8(7)15-9(10,11)12/h2-5H,1H3,(H,13,14)
5. Std. InChIKey: KZBHIVIJYKKLHL-UHFFFAOYSA-N

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