Cas no 4458-18-8 (5-(Aminomethyl)pyrimidine-2,4-diamine)

5-(Aminomethyl)pyrimidine-2,4-diamine is a pyrimidine derivative featuring both aminomethyl and diamine functional groups, making it a versatile intermediate in organic synthesis and pharmaceutical applications. Its structural framework is particularly valuable for constructing heterocyclic compounds, with potential utility in the development of nucleoside analogs or enzyme inhibitors. The presence of multiple reactive sites allows for selective modifications, enabling tailored derivatization for targeted research or industrial processes. This compound’s stability and well-defined reactivity profile make it suitable for use in controlled synthetic pathways, including medicinal chemistry and materials science. Proper handling under standard laboratory conditions is recommended due to its amine functionality.
5-(Aminomethyl)pyrimidine-2,4-diamine structure
4458-18-8 structure
Product Name:5-(Aminomethyl)pyrimidine-2,4-diamine
CAS No:4458-18-8
MF:C5H9N5
MW:139.158459424973
CID:324576
PubChem ID:227659
Update Time:2025-06-07

5-(Aminomethyl)pyrimidine-2,4-diamine Chemical and Physical Properties

Names and Identifiers

    • 5-(Aminomethyl)pyrimidine-2,4-diamine
    • 2,4-DIAMINO-5-AMINOMETHYL-PYRIMIDINE
    • 2,4-Pyrimidinediamine,5-(aminomethyl)-
    • C5H9N5
    • CUSTOM SYNTHESIS: 5-(AMINOMETHYL)-2,4-PYRIMIDINE DIAMINO
    • 2,4-Diamino-5-aminomethyl-pyrimidin
    • 5-Aminomethyl-pyrimidin-2,4-diyldiamin
    • 5-aminomethyl-pyrimidine-2,4-diyldiamine
    • 5-AMINOMETHYL-2,4-DIAMINOPYRIMIDINE
    • 4458-18-8
    • SCHEMBL5691391
    • GSCPVFNKSWRDMO-UHFFFAOYSA-N
    • AB24939
    • CS-0045839
    • AKOS006295609
    • 2,4-diamino-5-aminomethylpyrimidine
    • 2,4-Diamine-5-(Aminomethyl)pyrimidine
    • A7076
    • AMY11433
    • FT-0646234
    • C15813
    • MDL: MFCD06410824
    • Inchi: 1S/C5H9N5/c6-1-3-2-9-5(8)10-4(3)7/h2H,1,6H2,(H4,7,8,9,10)
    • InChI Key: GSCPVFNKSWRDMO-UHFFFAOYSA-N
    • SMILES: N1C(N)=NC=C(C=1N)CN

Computed Properties

  • Exact Mass: 139.08600
  • Monoisotopic Mass: 139.086
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 106
  • 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: 104A^2
  • XLogP3: -1.1

Experimental Properties

  • Density: 1.385g/cm3
  • Boiling Point: 458.2oC at 760 mmHg
  • Flash Point: 261.7oC
  • Refractive Index: 1.712
  • PSA: 103.84000
  • LogP: 0.96240

5-(Aminomethyl)pyrimidine-2,4-diamine 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-(Aminomethyl)pyrimidine-2,4-diamine Pricemore >>

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