Cas no 114969-66-3 (5-Bromopyrimidine-4-carbonitrile)

5-Bromopyrimidine-4-carbonitrile structure
114969-66-3 structure
Product Name:5-Bromopyrimidine-4-carbonitrile
CAS No:114969-66-3
MF:C5H2BrN3
MW:183.993479251862
MDL:MFCD09999211
CID:1028231
PubChem ID:13860987
Update Time:2025-04-20

5-Bromopyrimidine-4-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 4-Cyano-5-bromopyrimidine
    • 5-Bromo-4-cyanopyrimidine
    • 5-bromo-4-Pyrimidinecarbonitrile
    • 5-Bromopyrimidine-4-carbonitrile
    • 4-PYRIMIDINECARBONITRILE,5-BROMO
    • 5-Bromo-4-cyanopyrinidine
    • 4-PYRIMIDINECARBONITRILE, 5-BROMO-
    • NVDDWOVFQZUEGS-UHFFFAOYSA-N
    • 5-bromanylpyrimidine-4-carbonitrile
    • RP08366
    • PB34510
    • AB1011574
    • ST1141023
    • AB0031768
    • X4969
    • AM20080092
    • A803274
    • DTXSID60551366
    • CS-0050557
    • 114969-66-3
    • SCHEMBL4629776
    • DS-10652
    • W-204838
    • AKOS006305458
    • 4-PYRIMIDINECARBONITRILE,5-BROMO;
    • MFCD09999211
    • SY098603
    • DB-060653
    • MDL: MFCD09999211
    • Inchi: 1S/C5H2BrN3/c6-4-2-8-3-9-5(4)1-7/h2-3H
    • InChI Key: NVDDWOVFQZUEGS-UHFFFAOYSA-N
    • SMILES: BrC1=CN=CN=C1C#N

Computed Properties

  • Exact Mass: 182.94300
  • Monoisotopic Mass: 182.94321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 138
  • 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
  • Topological Polar Surface Area: 49.6
  • XLogP3: 0.9

Experimental Properties

  • PSA: 49.57000
  • LogP: 1.11078

5-Bromopyrimidine-4-carbonitrile 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-Bromopyrimidine-4-carbonitrile Pricemore >>

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5-Bromopyrimidine-4-carbonitrile Production Method

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