Cas no 1261913-27-2 (4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid)

4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid structure
1261913-27-2 structure
Product Name:4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid
CAS No:1261913-27-2
MF:C14H8FNO6
MW:305.214827537537
MDL:MFCD18321486
CID:2763075
PubChem ID:53227358
Update Time:2025-04-21

4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-(3-CARBOXY-5-FLUOROPHENYL)-2-NITROBENZOIC ACID
    • 5-Fluoro-3'-nitro[1,1'-biphenyl]-3,4'-dicarboxylic acid
    • DTXSID90690914
    • 4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid, 95%
    • MFCD18321486
    • 1261913-27-2
    • 4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid
    • MDL: MFCD18321486
    • Inchi: 1S/C14H8FNO6/c15-10-4-8(3-9(5-10)13(17)18)7-1-2-11(14(19)20)12(6-7)16(21)22/h1-6H,(H,17,18)(H,19,20)
    • InChI Key: MKURKDFKKDNBSG-UHFFFAOYSA-N
    • SMILES: FC1C=C(C(=O)O)C=C(C=1)C1C=CC(C(=O)O)=C(C=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 305.03356514Da
  • Monoisotopic Mass: 305.03356514Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 465
  • 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: 2.5
  • Topological Polar Surface Area: 120?2

4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB328713-5g
4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid, 95%; .
1261913-27-2 95%
5g
€1159.00 2025-04-21
abcr
AB328713-5 g
4-(3-Carboxy-5-fluorophenyl)-2-nitrobenzoic acid, 95%; .
1261913-27-2 95%
5g
€1159.00 2023-04-26
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