Cas no 31083-14-4 (Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester)

Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester structure
31083-14-4 structure
Product Name:Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester
CAS No:31083-14-4
MF:C10H9F3O2
MW:218.172473669052
CID:303896
PubChem ID:521827
Update Time:2025-04-19

Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester Chemical and Physical Properties

Names and Identifiers

    • Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester
    • Benzoic acid, 4-(trifluoromethyl)-, ethyl ester
    • Ethyl 4-(trifluoromethyl)benzoate
    • 4-trifluoromethylbenzoic acid ethyl ester
    • 4-trifluoromethylbenzoic acid ester
    • ethyl 4-trifluoromethylbenzoate
    • AKOS008948271
    • MFCD00013563
    • 583-02-8
    • SCHEMBL668192
    • CS-0042073
    • 31083-14-4
    • 4-(trifluoromethyl)benzoic acid ethyl ester
    • DS-5181
    • FT-0626051
    • SY016093
    • 2-{[(4-Chlorophenyl)amino]carbonyl}cyclohexanecarboxylicacid
    • FT-0616915
    • E1330
    • Ethyl-p-trifluoromethylbenzoate
    • ethyl-4-trifluoromethyl benzoate
    • ethyl-4-(trifluoromethyl)benzoate
    • 4-Trifluoromethylbenzoic acid, ethyl ester
    • Inchi: 1S/C10H9F3O2/c1-2-15-9(14)7-3-5-8(6-4-7)10(11,12)13/h3-6H,2H2,1H3
    • InChI Key: ZQDADDSPMCHZPX-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC(C(=O)OCC)=CC=1)(F)F

Computed Properties

  • Exact Mass: 218.05547
  • Monoisotopic Mass: 218.05546401g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 217
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.238
  • Boiling Point: 81°C 5mm
  • Flash Point: 42.652 °C
  • Refractive Index: 1.449
  • PSA: 26.3
  • Solubility: Not determined

Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester Security Information

  • Hazardous Material Identification: F
  • HazardClass:FLAMMABLE
  • Safety Term:S24/25

Aceticacid, 2,2,2-trifluoro-, 4-ethylphenyl ester Pricemore >>

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