Cas no 5305-43-1 (5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo-)

5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo- structure
5305-43-1 structure
Product Name:5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo-
CAS No:5305-43-1
MF:C5H2ClN3O
MW:155.541879177094
MDL:MFCD29922211
CID:1580203
PubChem ID:135703354
Update Time:2025-09-21

5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo- Chemical and Physical Properties

Names and Identifiers

    • 5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo-
    • 4-chloro-6-hydroxypyrimidine-5-carbonitrile
    • 6-chloro-4-oxo-1,4-dihydropyrimidine-5-carbonitrile
    • SCHEMBL8237323
    • 4-Chlor-5-cyano-6-hydroxypyrimidin
    • PEBPXXOYLASTAA-UHFFFAOYSA-N
    • MFCD29922211
    • 6-Oxo-4-chloro-5-cyano-1,6-dihydropyrimidine
    • 6-Chloro-5-cyano-3,4-dihydropyrimidin-4-one
    • DA-05163
    • AC8479
    • 5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo
    • 4-Chloro-6-oxo-1,6-dihydro-5-pyrimidinecarbonitrile #
    • SY250530
    • 5305-43-1
    • DTXSID501346901
    • 5-Pyrimidinecarbonitrile,6-chloro-1,4-dihydro-4-oxo
    • MDL: MFCD29922211
    • Inchi: 1S/C5H2ClN3O/c6-4-3(1-7)5(10)9-2-8-4/h2H,(H,8,9,10)
    • InChI Key: PEBPXXOYLASTAA-UHFFFAOYSA-N
    • SMILES: ClC1=C(C#N)C(NC=N1)=O

Computed Properties

  • Exact Mass: 154.98900
  • Monoisotopic Mass: 154.989
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 283
  • 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: 0.1
  • Topological Polar Surface Area: 65.2?2

Experimental Properties

  • PSA: 69.80000
  • LogP: 0.70728

5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo- 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%

5-Pyrimidinecarbonitrile, 6-chloro-1,4-dihydro-4-oxo- Pricemore >>

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