Cas no 503315-75-1 (2-(3-fluoro-4-nitrophenyl)acetonitrile)

2-(3-fluoro-4-nitrophenyl)acetonitrile structure
503315-75-1 structure
Product Name:2-(3-fluoro-4-nitrophenyl)acetonitrile
CAS No:503315-75-1
MF:C8H5FN2O2
MW:180.13590502739
MDL:MFCD03094238
CID:1565232
PubChem ID:2774666
Update Time:2025-04-21

2-(3-fluoro-4-nitrophenyl)acetonitrile Chemical and Physical Properties

Names and Identifiers

    • 2-(3-fluoro-4-nitrophenyl)acetonitrile
    • 3-Fluoro-4-nitrophenylacetonitrile
    • AC1MCOS6
    • CTK7C9717
    • MolPort-001-775-568
    • PC4405
    • SBB089631
    • AG-A-60167
    • CL8963
    • EN300-1843166
    • AS-46154
    • SCHEMBL20339048
    • CS-0157106
    • AKOS027254611
    • DTXSID20379164
    • (3-Fluoro-4-nitrophenyl)acetonitrile
    • 503315-75-1
    • MFCD03094238
    • MDL: MFCD03094238
    • Inchi: 1S/C8H5FN2O2/c9-7-5-6(3-4-10)1-2-8(7)11(12)13/h1-2,5H,3H2
    • InChI Key: MWYMXAMNWIADMW-UHFFFAOYSA-N
    • SMILES: FC1=C(C=CC(CC#N)=C1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 180.03350557g/mol
  • Monoisotopic Mass: 180.03350557g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 242
  • 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: 1.5
  • Topological Polar Surface Area: 69.6?2

2-(3-fluoro-4-nitrophenyl)acetonitrile Security Information

  • Hazard Statement: Irritant
  • Hazardous Material Identification: Xi

2-(3-fluoro-4-nitrophenyl)acetonitrile Pricemore >>

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