Cas no 853771-93-4 (4-Methoxy-3-(trifluoromethoxy)phenylacetonitrile)

4-Methoxy-3-(trifluoromethoxy)phenylacetonitrile structure
853771-93-4 structure
Product Name:4-Methoxy-3-(trifluoromethoxy)phenylacetonitrile
CAS No:853771-93-4
MF:C10H8F3NO2
MW:231.171233177185
CID:3166184
PubChem ID:66523516
Update Time:2025-04-21

4-Methoxy-3-(trifluoromethoxy)phenylacetonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-Methoxy-3-(trifluoromethoxy)phenylacetonitrile
    • 853771-93-4
    • CS-0326256
    • SCHEMBL6361965
    • AKOS015957093
    • [4-methoxy-3-(trifluoromethoxy)phenyl]acetonitrile
    • 2-(4-Methoxy-3-(trifluoromethoxy)phenyl)acetonitrile
    • 2-[4-METHOXY-3-(TRIFLUOROMETHOXY)PHENYL]ACETONITRILE
    • MDL: MFCD18398529
    • Inchi: 1S/C10H8F3NO2/c1-15-8-3-2-7(4-5-14)6-9(8)16-10(11,12)13/h2-3,6H,4H2,1H3
    • InChI Key: ODCXKGJQTLIKAX-UHFFFAOYSA-N
    • SMILES: FC(OC1=C(C=CC(CC#N)=C1)OC)(F)F

Computed Properties

  • Exact Mass: 231.051
  • Monoisotopic Mass: 231.051
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 271
  • 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
  • XLogP3: 2.4
  • Topological Polar Surface Area: 42.2A^2

4-Methoxy-3-(trifluoromethoxy)phenylacetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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