Cas no 1000339-92-3 (2-(2-Fluoro-5-nitrophenyl)acetonitrile)

2-(2-Fluoro-5-nitrophenyl)acetonitrile structure
1000339-92-3 structure
Product Name:2-(2-Fluoro-5-nitrophenyl)acetonitrile
CAS No:1000339-92-3
MF:C8H5FN2O2
MW:180.13590502739
MDL:MFCD09864689
CID:97687
PubChem ID:24828410
Update Time:2025-04-18

2-(2-Fluoro-5-nitrophenyl)acetonitrile Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetonitrile,2-fluoro-5-nitro-
    • 2-(2-fluoro-5-nitrophenyl)acetonitrile
    • 2-Fluoro-5-nitrophenylacetonitrile
    • Benzeneacetonitrile,2-fluoro-5-nitro
    • PC8610
    • Benzeneacetonitrile, 2-fluoro-5-nitro-
    • (2-Fluoro-5-nitro-phenyl)-acetonitrile
    • CS-0318941
    • 2-(2-Fluoro-5-nitro-phenyl)acetonitrile
    • SCHEMBL18041455
    • AT11183
    • FT-0696608
    • 1000339-92-3
    • AKOS024258422
    • SQSDEFBOBWGPAS-UHFFFAOYSA-N
    • MFCD09864689
    • (2-Fluoro-5-nitrophenyl)acetonitrile
    • A800010
    • DTXSID10647622
    • SB30003
    • 2-(2-Fluoro-5-nitrophenyl)acetonitrile
    • MDL: MFCD09864689
    • Inchi: 1S/C8H5FN2O2/c9-8-2-1-7(11(12)13)5-6(8)3-4-10/h1-2,5H,3H2
    • InChI Key: SQSDEFBOBWGPAS-UHFFFAOYSA-N
    • SMILES: FC1=CC=C(C=C1CC#N)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 180.03400
  • Monoisotopic Mass: 180.034
  • 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
  • Topological Polar Surface Area: 69.6A^2
  • XLogP3: 1.5

Experimental Properties

  • Density: 1.367
  • Boiling Point: 334.7 °C at 760 mmHg
  • Flash Point: 156.2 °C
  • PSA: 69.61000
  • LogP: 2.32318

2-(2-Fluoro-5-nitrophenyl)acetonitrile Security Information

  • Hazardous Material Identification: T

2-(2-Fluoro-5-nitrophenyl)acetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B435188-50mg
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1000339-92-3
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$ 50.00 2022-06-07
TRC
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1000339-92-3 96%
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JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
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JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd.
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abcr
AB232544-1 g
2-Fluoro-5-nitrophenylacetonitrile
1000339-92-3
1g
€564.60 2023-04-27

2-(2-Fluoro-5-nitrophenyl)acetonitrile Production Method

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