Cas no 1261985-62-9 (2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid)

2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid structure
1261985-62-9 structure
Product Name:2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid
CAS No:1261985-62-9
MF:C16H12FNO6
MW:333.267988204956
MDL:MFCD18322610
CID:2621985
PubChem ID:53228429
Update Time:2025-04-21

2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid, 95%
    • 4'-(Ethoxycarbonyl)-3'-fluoro-5-nitro[1,1'-biphenyl]-2-carboxylic acid
    • DTXSID50691962
    • 1261985-62-9
    • 2-[4-(ETHOXYCARBONYL)-3-FLUOROPHENYL]-4-NITROBENZOIC ACID
    • MFCD18322610
    • 2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid
    • MDL: MFCD18322610
    • Inchi: 1S/C16H12FNO6/c1-2-24-16(21)12-5-3-9(7-14(12)17)13-8-10(18(22)23)4-6-11(13)15(19)20/h3-8H,2H2,1H3,(H,19,20)
    • InChI Key: RKFZYJUCUIAXCF-UHFFFAOYSA-N
    • SMILES: FC1=C(C(=O)OCC)C=CC(=C1)C1C=C(C=CC=1C(=O)O)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 333.06486526Da
  • Monoisotopic Mass: 333.06486526Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 5
  • Complexity: 493
  • 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: 3.2
  • Topological Polar Surface Area: 109?2

2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB329887-5 g
2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid, 95%; .
1261985-62-9 95%
5g
€1159.00 2023-04-26
abcr
AB329887-5g
2-[4-(Ethoxycarbonyl)-3-fluorophenyl]-4-nitrobenzoic acid, 95%; .
1261985-62-9 95%
5g
€1159.00 2025-03-19
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