Cas no 79574-70-2 (3-Acetyl-2-fluoropyridine)

3-Acetyl-2-fluoropyridine structure
3-Acetyl-2-fluoropyridine structure
Product Name:3-Acetyl-2-fluoropyridine
CAS No:79574-70-2
MF:C7H6FNO
MW:139.127045154572
MDL:MFCD07375072
CID:60106
PubChem ID:12711122
Update Time:2024-10-27

3-Acetyl-2-fluoropyridine Chemical and Physical Properties

Names and Identifiers

    • 3-Acetyl-2-fluoropyridine
    • 1-(2-fluoropyridin-3-yl)ethanone
    • 1-(2-fluoropyridin-3-yl)ethan-1-one
    • ETHANONE, 1-(2-FLUORO-3-PYRIDINYL)-
    • PubChem5049
    • KSC497Q7D
    • 1-(2-fluoro-3-pyridyl)ethanone
    • 2-FLUORO-3-ACETYLPYRIDINE
    • KEEHTCBOJCVCNO-UHFFFAOYSA-N
    • 1-(2-fluoropyridine-3-yl)ethanone
    • 1-(2-Fluoro-3-pyridinyl)-ethanone
    • SBB065563
    • PC6971
    • Ethanone,1-(2-fluoro-3-pyridinyl)-
    • CS-0044029
    • AC-7711
    • 1-(2-fluoro-pyridin-3-yl)-ethanone
    • 3-acetyl-2-fluoropyridine, AldrichCPR
    • AM20061515
    • FT-0656432
    • F31395
    • Z1255403471
    • MFCD07375072
    • AB41104
    • EN300-136481
    • SCHEMBL1811012
    • 79574-70-2
    • PS-9068
    • SY064682
    • DTXSID30507653
    • A9916
    • AKOS005762915
    • J-503017
    • 1-(2-Fluoro-3-pyridinyl)ethanone (ACI)
    • DB-050542
    • 1-(2-Fluoropyridin-3-yl)ethan-1-one, 3-Ethanoyl-2-fluoropyridine
    • MDL: MFCD07375072
    • Inchi: 1S/C7H6FNO/c1-5(10)6-3-2-4-9-7(6)8/h2-4H,1H3
    • InChI Key: KEEHTCBOJCVCNO-UHFFFAOYSA-N
    • SMILES: O=C(C)C1C(F)=NC=CC=1

Computed Properties

  • Exact Mass: 139.04300
  • Monoisotopic Mass: 139.043341977g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 138
  • 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
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 1
  • Topological Polar Surface Area: 30

Experimental Properties

  • Density: 1.175
  • Boiling Point: 232.4 oC at 760 mmHg
  • Flash Point: 94.4 oC
  • Refractive Index: 1.492
  • PSA: 29.96000
  • LogP: 1.42330

3-Acetyl-2-fluoropyridine Security Information

  • Hazard Statement: Irritant
  • Hazard Category Code: 22-36
  • Safety Instruction: 26
  • Hazardous Material Identification: Xi

3-Acetyl-2-fluoropyridine Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-Acetyl-2-fluoropyridine Pricemore >>

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3-Acetyl-2-fluoropyridine Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Butyllithium ,  Diisopropylethylamine Solvents: Tetrahydrofuran ,  Hexane ;  -40 °C; 30 min, -40 °C; -40 °C → -70 °C
1.2 -70 °C; 30 min, -70 °C
1.3 Solvents: Tetrahydrofuran ;  < -60 °C; 30 min, -70 °C
1.4 Reagents: Hydrochloric acid Solvents: Water
Reference
A facile synthesis of 2,3-disubstituted furo[2,3-b]pyridines
Beutner, Gregory L.; Kuethe, Jeffrey T.; Yasuda, Nobuyoshi, Tetrahedron Letters, 2009, 50(7), 781-784

Production Method 2

Reaction Conditions
1.1 Reagents: Chromium trioxide
Reference
Regioselective metalation in the pyridine series: original synthesis of 3-aroyl-2-aminopyridines
Gungor, Timur; Marsais, Francis; Queguiner, Guy, Journal of Organometallic Chemistry, 1981, 215(2), 139-50

3-Acetyl-2-fluoropyridine Raw materials

3-Acetyl-2-fluoropyridine Preparation Products

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