Cas no 15450-73-4 (2,5,8(1H)-Quinolinetrione)

2,5,8(1H)-Quinolinetrione structure
2,5,8(1H)-Quinolinetrione structure
Product Name:2,5,8(1H)-Quinolinetrione
CAS No:15450-73-4
MF:C9H5NO3
MW:175.140902280807
CID:204327
PubChem ID:267592
Update Time:2025-04-19

2,5,8(1H)-Quinolinetrione Chemical and Physical Properties

Names and Identifiers

    • 2,5,8(1H)-Quinolinetrione
    • 1H-quinoline-2,5,8-trione
    • 5,8-dioxocarbostyril
    • 5,8-dioxocarbostyryl
    • carbostirylquinone
    • carbostyrylquinone
    • JXTKZMFPFKZRHP-UHFFFAOYSA
    • NSC107098
    • 2,5,8-quinolinetrione
    • JXTKZMFPFKZRHP-UHFFFAOYSA-
    • InChI=1/C9H5NO3/c11-6-2-3-7(12)9-5(6)1-4-8(13)10-9/h1-4H,(H,10,13)
    • 15450-73-4
    • DTXSID70296019
    • NSC-107098
    • SCHEMBL6407655
    • NSC 107098
    • 2,8(1H)-Quinolinetrione
    • JXTKZMFPFKZRHP-UHFFFAOYSA-N
    • Inchi: 1S/C9H5NO3/c11-6-2-3-7(12)9-5(6)1-4-8(13)10-9/h1-4H,(H,10,13)
    • InChI Key: JXTKZMFPFKZRHP-UHFFFAOYSA-N
    • SMILES: O=C1C=CC(C2C=CC(NC=21)=O)=O

Computed Properties

  • Exact Mass: 175.02700
  • Monoisotopic Mass: 175.026943022g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 413
  • 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: -0.3
  • Topological Polar Surface Area: 63.2?2

Experimental Properties

  • PSA: 67.00000
  • LogP: 0.31010

2,5,8(1H)-Quinolinetrione Customs Data

  • HS CODE:2933499090
  • Customs Data:

    China Customs Code:

    2933499090

    Overview:

    2933499090. Other compounds containing quinoline or isoquinoline ring system [but not further fused]. 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:

    2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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