Cas no 1214367-00-6 (Ethyl 2,5-difluoro-4-nitrobenzoate)

Ethyl 2,5-difluoro-4-nitrobenzoate is a fluorinated aromatic ester with applications in pharmaceutical and agrochemical synthesis. Its structure, featuring both nitro and fluoro substituents, enhances reactivity in nucleophilic aromatic substitution and other transformations. The ethyl ester group improves solubility in organic solvents, facilitating handling in synthetic workflows. This compound serves as a versatile intermediate for constructing complex molecules, particularly in the development of bioactive compounds. Its stability under standard storage conditions and well-characterized reactivity profile make it a reliable choice for research and industrial applications. The presence of electron-withdrawing groups further enables selective functionalization, broadening its utility in fine chemical synthesis.
Ethyl 2,5-difluoro-4-nitrobenzoate structure
1214367-00-6 structure
Product Name:Ethyl 2,5-difluoro-4-nitrobenzoate
CAS No:1214367-00-6
MF:C9H7F2NO4
MW:231.152989625931
MDL:MFCD14698225
CID:1036671
PubChem ID:46311350
Update Time:2025-05-27

Ethyl 2,5-difluoro-4-nitrobenzoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2,5-difluoro-4-nitrobenzoate
    • Benzoic acid, 2,5-difluoro-4-nitro-, ethyl ester
    • AS-67768
    • MFCD14698225
    • AKOS016015023
    • CS-0061574
    • DB-342910
    • 1214367-00-6
    • AMY6549
    • SCHEMBL25352364
    • DTXSID80673271
    • Ethyl2,5-difluoro-4-nitrobenzoate
    • MDL： MFCD14698225
    • Inchi： 1S/C9H7F2NO4/c1-2-16-9(13)5-3-7(11)8(12(14)15)4-6(5)10/h3-4H,2H2,1H3
    • InChI Key： BKVLJZWOBHTSHB-UHFFFAOYSA-N
    • SMILES： FC1C=C(C(=CC=1C(=O)OCC)F)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 231.03431403g/mol
  • Monoisotopic Mass: 231.03431403g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 281
  • 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: 2.2
  • Topological Polar Surface Area: 72.1?2

Ethyl 2,5-difluoro-4-nitrobenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A019098569-1g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
1g
 $400.00 2023-09-04
A2B Chem LLC
AA52807-100mg
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
100mg
 $30.00 2024-04-20
A2B Chem LLC
AA52807-250mg
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
250mg
 $49.00 2024-04-20
A2B Chem LLC
AA52807-500mg
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
500mg
 $65.00 2024-04-20
A2B Chem LLC
AA52807-1g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
1g
 $89.00 2024-04-20
A2B Chem LLC
AA52807-2g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
2g
 $150.00 2024-04-20
A2B Chem LLC
AA52807-5g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
5g
 $235.00 2024-04-20
A2B Chem LLC
AA52807-10g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
10g
 $415.00 2024-04-20
A2B Chem LLC
AA52807-15g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
15g
 $589.00 2024-04-20
A2B Chem LLC
AA52807-25g
Ethyl 2,5-difluoro-4-nitrobenzoate
 1214367-00-6 95%
25g
 $820.00 2024-04-20

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