Cas no 71682-96-7 (2,5-Difluorobenzoylacetonitrile)

2,5-Difluorobenzoylacetonitrile structure
71682-96-7 structure
Product Name:2,5-Difluorobenzoylacetonitrile
CAS No:71682-96-7
MF:C9H5F2NO
MW:181.138909101486
MDL:MFCD02260805
CID:547990
PubChem ID:12540175
Update Time:2025-04-19

2,5-Difluorobenzoylacetonitrile Chemical and Physical Properties

Names and Identifiers

    • 3-(2,5-Difluorophenyl)-3-oxopropanenitrile
    • 2,5-DIFLUOROBENZOYLACETONITRILE
    • 2,4-DIFLUOROBENZOYLACETONITRILE
    • 2,5-Difluoro-beta-Oxo-Benzenepropanenitrile
    • 2,5-Difluoro-b-oxo-benzenepropanenitrile
    • AM1160
    • 3-Oxo-3-(2,5-difluorophenyl)propanenitrile
    • AB93029
    • 2',5'-Difluorobenzoylacetonitrile
    • Benzenepropanenitrile, 2,5-difluoro-beta-oxo-
    • C78418
    • 71682-96-7
    • SCHEMBL11344457
    • MFCD02260805
    • MRKQEVHBBWQIAD-UHFFFAOYSA-N
    • AKOS000172997
    • A9376
    • CS-0319519
    • FT-0604198
    • DTXSID10501811
    • 2,5-Difluorobenzoylacetonitrile
    • MDL： MFCD02260805
    • Inchi： 1S/C9H5F2NO/c10-6-1-2-8(11)7(5-6)9(13)3-4-12/h1-2,5H,3H2
    • InChI Key： MRKQEVHBBWQIAD-UHFFFAOYSA-N
    • SMILES： FC1C=CC(=CC=1C(CC#N)=O)F

Computed Properties

  • Exact Mass: 181.03400
  • Monoisotopic Mass: 181.03392011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 245
  • 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: 1.7
  • Topological Polar Surface Area: 40.9?2

Experimental Properties

  • Density: 1.3
  • Boiling Point: 303.6°C at 760 mmHg
  • Flash Point: 137.4°C
  • Refractive Index: 1.497
  • PSA: 40.86000
  • LogP: 2.06118

2,5-Difluorobenzoylacetonitrile Customs Data

  • HS CODE：2926909090
  • Customs Data：

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2,5-Difluorobenzoylacetonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D445425-1g
2,5-Difluorobenzoylacetonitrile
 71682-96-7
1g
 $ 125.00 2022-06-05
TRC
D445425-5g
2,5-Difluorobenzoylacetonitrile
 71682-96-7
5g
 $ 380.00 2022-06-05
TRC
D445425-25g
2,5-Difluorobenzoylacetonitrile
 71682-96-7
25g
 $ 1495.00 2022-06-05
Apollo Scientific
PC9046-250mg
2,5-Difluorobenzoylacetonitrile
 71682-96-7
250mg
 ￡120.00 2025-02-22
Apollo Scientific
PC9046-1g
2,5-Difluorobenzoylacetonitrile
 71682-96-7
1g
 ￡280.00 2025-02-22
Apollo Scientific
PC9046-5g
2,5-Difluorobenzoylacetonitrile
 71682-96-7
5g
 ￡800.00 2025-02-22
abcr
AB233095-1 g
2,5-Difluorobenzoylacetonitrile; .
 71682-96-7
1g
 €186.70 2023-04-27
abcr
AB233095-5 g
2,5-Difluorobenzoylacetonitrile; .
 71682-96-7
5g
 €548.80 2023-04-27
TRC
D445425-1000mg
2,5-Difluorobenzoylacetonitrile
 71682-96-7
1g
 $155.00 2023-05-18
TRC
D445425-5000mg
2,5-Difluorobenzoylacetonitrile
 71682-96-7
5g
 $460.00 2023-05-18

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