Cas no 1072207-10-3 (Ethyl 4-fluoro-2-nitrobenzoate)

Ethyl 4-fluoro-2-nitrobenzoate structure
1072207-10-3 structure
Product Name:Ethyl 4-fluoro-2-nitrobenzoate
CAS No:1072207-10-3
MF:C9H8FNO4
MW:213.162526130676
MDL:MFCD10566267
CID:1057082
PubChem ID:46311379
Update Time:2025-04-20

Ethyl 4-fluoro-2-nitrobenzoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4-Fluoro-2-nitrobenzoate
    • Ethyl4-Fluoro-2-nitrobenzoate
    • 6777AJ
    • SY019385
    • 4-Fluoro-2-nitro-benzoic acid ethyl ester
    • SCHEMBL3092769
    • AC2320
    • AKOS027256679
    • DA-19062
    • CS-11399
    • 1072207-10-3
    • MFCD10566267
    • Ethyl 4-fluoro-2-nitrobenzoate
    • MDL： MFCD10566267
    • Inchi： 1S/C9H8FNO4/c1-2-15-9(12)7-4-3-6(10)5-8(7)11(13)14/h3-5H,2H2,1H3
    • InChI Key： MTDIULWIFTZWEF-UHFFFAOYSA-N
    • SMILES： FC1C=CC(C(=O)OCC)=C(C=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 213.04400
  • Monoisotopic Mass: 213.04373590g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 253
  • 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

Experimental Properties

  • PSA: 72.12000
  • LogP: 2.43380

Ethyl 4-fluoro-2-nitrobenzoate Pricemore >>

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