Cas no 87789-78-4 (2-Pyridinecarboxylicacid, 5-(4-nitrophenyl)-)

2-Pyridinecarboxylicacid, 5-(4-nitrophenyl)- structure
87789-78-4 structure
Product Name:2-Pyridinecarboxylicacid, 5-(4-nitrophenyl)-
CAS No:87789-78-4
MF:C12H8N2O4
MW:244.202922821045
CID:708950
PubChem ID:23335280
Update Time:2025-04-19

2-Pyridinecarboxylicacid, 5-(4-nitrophenyl)- Chemical and Physical Properties

Names and Identifiers

    • 2-Pyridinecarboxylicacid, 5-(4-nitrophenyl)-
    • 5-(4-Nitrophenyl)-picolinic acid
    • 5-(4-nitrophenyl)pyridine-2-carboxylic acid
    • 2-Pyridinecarboxylicacid,5-(4-nitrophenyl)
    • 5-(p-nitrophenyl)picolinic acid
    • DTXSID60633055
    • 87789-78-4
    • SCHEMBL11410325
    • 5-(4-nitrophenyl)picolinic acid
    • Inchi: 1S/C12H8N2O4/c15-12(16)11-6-3-9(7-13-11)8-1-4-10(5-2-8)14(17)18/h1-7H,(H,15,16)
    • InChI Key: DAYPHWSUHWTOLC-UHFFFAOYSA-N
    • SMILES: OC(C1=CC=C(C=N1)C1C=CC(=CC=1)[N+](=O)[O-])=O

Computed Properties

  • Exact Mass: 244.04800
  • Monoisotopic Mass: 244.04840674g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 321
  • 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: 96?2

Experimental Properties

  • PSA: 96.01000
  • LogP: 2.87820

2-Pyridinecarboxylicacid, 5-(4-nitrophenyl)- 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%

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