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4-Chloro-2,6-diaminopyrimidine

Short Description:


  • Chemical Name: 4-Chloro-2,6-diaminopyrimidine
  • CAS No.: 156-83-2
  • Molecular Formula: C4H5ClN4
  • Counting Atoms: 4 Carbon atoms,5 Hydrogen atoms,1 Chlorine atoms,4 Nitrogen atoms,
  • Molecular Weight: 144.564
  • Hs Code.: 29335995
  • European Community (EC) Number: 205-863-9
  • NSC Number: 8818
  • UNII: 83NU5F7ZAS
  • DSSTox Substance ID: DTXSID30166022
  • Nikkaji Number: J106.036H
  • Wikidata: Q27453431
  • ChEMBL ID: CHEMBL4517551
  • Mol file: 156-83-2.mol
  • Product Detail

    Product Tags

    product

    Synonyms:Pyrimidine,2,4-diamino-6-chloro- (6CI,7CI,8CI);2,6-Diamino-4-chloropyrimidine;6-Chloro-2,4-diaminopyrimidine;6-Chloropyrimidine-2,4-diamine;NSC 8818;

    Chemical Property of 4-Chloro-2,6-diaminopyrimidine

    ● Appearance/Colour:white cyrstalline solid
    ● Vapor Pressure:7.01E-08mmHg at 25°C
    ● Melting Point:199-202 °C(lit.)
    ● Refractive Index:1.702
    ● Boiling Point:438.3 °C at 760 mmHg
    ● PKA:3.66±0.10(Predicted)
    ● Flash Point:218.9 °C
    ● PSA:77.82000
    ● Density:1.564 g/cm3
    ● LogP:1.45680

    ● Storage Temp.:-20°C Freezer
    ● Solubility.:slightly soluble
    ● Water Solubility.:slightly soluble
    ● XLogP3:0.5
    ● Hydrogen Bond Donor Count:2
    ● Hydrogen Bond Acceptor Count:4
    ● Rotatable Bond Count:0
    ● Exact Mass:144.0202739
    ● Heavy Atom Count:9
    ● Complexity:98.6

    Purity/Quality

    99% *data from raw suppliers

    6-Chloro-pyrimidine-2,4-diamine *data from reagent suppliers

    Safty Information

    ● Pictogram(s):product (2)Xi, product (2)Xn
    ● Hazard Codes:Xn,Xi
    ● Statements:22-36/37/38
    ● Safety Statements:26-24/25

    Useful

    ● Canonical SMILES: C1=C(N=C(N=C1Cl)N)N
    ● Uses: Melamine and Related Compounds in Dog Food Using GC-MS
    4-Chloro-2,6-diaminopyrimidine is a chemical compound with the molecular formula C4H5ClN4. It is a chlorinated derivative of the pyrimidine ring structure with two amino groups (NH2) attached to different carbon atoms.This compound has various applications in the field of organic synthesis and medicinal chemistry. It is commonly used as a building block for the synthesis of biologically active compounds, such as pharmaceutical drugs and agrochemicals.4-Chloro-2,6-diaminopyrimidine can undergo various chemical reactions, including substitution, addition, and condensation reactions. Its chlorinated nature can make it more reactive towards nucleophilic substitution reactions.In medicinal chemistry, this compound is often used as a starting material for the synthesis of pyrimidine-based drugs. It can also be used as a key intermediate in the synthesis of pesticides, herbicides, and fungicides.4-Chloro-2,6-diaminopyrimidine is an important compound that serves as a versatile building block in organic synthesis and finds applications in the development of various pharmaceutical and agricultural products.


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