Cas no 886761-71-3 (3-Fluoro-4-(trifluoromethoxy)phenylacetonitrile)

3-Fluoro-4-(trifluoromethoxy)phenylacetonitrile structure
886761-71-3 structure
Product Name:3-Fluoro-4-(trifluoromethoxy)phenylacetonitrile
CAS No:886761-71-3
MF:C9H5F4NO
MW:219.135716199875
MDL:MFCD06660344
CID:3142881
PubChem ID:17999358
Update Time:2025-04-21

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

Names and Identifiers

    • 3-Fluoro-4-(trifluoromethoxy)phenylacetonitrile
    • CS-0330562
    • 2-[3-FLUORO-4-(TRIFLUOROMETHOXY)PHENYL]ACETONITRILE
    • 886761-71-3
    • AKOS015956783
    • DTXSID401239333
    • MIDNSRCOEGRXAX-UHFFFAOYSA-N
    • JS-4515
    • G89439
    • 3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile
    • 2-(3-Fluoro-4-(trifluoromethoxy)phenyl)acetonitrile
    • MFCD06660344
    • SCHEMBL4189596
    • MDL： MFCD06660344
    • Inchi： 1S/C9H5F4NO/c10-7-5-6(3-4-14)1-2-8(7)15-9(11,12)13/h1-2,5H,3H2
    • InChI Key： MIDNSRCOEGRXAX-UHFFFAOYSA-N
    • SMILES： FC1C=C(CC#N)C=CC=1OC(F)(F)F

Computed Properties

  • Exact Mass: 219.03072643Da
  • Monoisotopic Mass: 219.03072643Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 257
  • 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: 2.9
  • Topological Polar Surface Area: 33?2

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

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abcr
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AB404053-5 g
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A2B Chem LLC
AH90469-1g
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