Cas no 1598-64-7 (2,4(1H,3H)-Pyrimidinedione,6-(fluoromethyl)-)

2,4(1H,3H)-Pyrimidinedione,6-(fluoromethyl)- structure
1598-64-7 structure
Product Name:2,4(1H,3H)-Pyrimidinedione,6-(fluoromethyl)-
CAS No:1598-64-7
MF:C5H5FN2O2
MW:144.103804349899
CID:217115
PubChem ID:233894
Update Time:2025-04-19

2,4(1H,3H)-Pyrimidinedione,6-(fluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • 2,4(1H,3H)-Pyrimidinedione,6-(fluoromethyl)-
    • 6-(fluoromethyl)-1H-pyrimidine-2,4-dione
    • Uracil, 6-(fluoromethyl)- (6CI,8CI)
    • 6-Fluormethyl-1H-pyrimidin-2,4-dion
    • 6-fluoromethyl-1H-pyrimidine-2,4-dione
    • 1598-64-7
    • 6-(Fluoromethyl)pyrimidine-2,4-diol
    • SCHEMBL5508748
    • DTXSID80936176
    • NSC33037
    • NSC-33037
    • Inchi： 1S/C5H5FN2O2/c6-2-3-1-4(9)8-5(10)7-3/h1H,2H2,(H2,7,8,9,10)
    • InChI Key： FIDATMMHDGLDFF-UHFFFAOYSA-N
    • SMILES： FCC1=CC(NC(N1)=O)=O

Computed Properties

  • Exact Mass: 144.03400
  • Monoisotopic Mass: 144.034
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 212
  • 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: _1
  • Topological Polar Surface Area: 58.2?2

Experimental Properties

  • Density: 1.318
  • Refractive Index: 1.458
  • PSA: 65.72000
  • LogP: -0.46730

2,4(1H,3H)-Pyrimidinedione,6-(fluoromethyl)- Customs Data

  • HS CODE：2933599090
  • Customs Data：

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the 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:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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