Cas no 659729-07-4 (4-(4-(tert-butyl)phenyl)-6-chloropyrimidine)

4-(4-(tert-butyl)phenyl)-6-chloropyrimidine structure
659729-07-4 structure
Product Name:4-(4-(tert-butyl)phenyl)-6-chloropyrimidine
CAS No:659729-07-4
MF:C14H15ClN2
MW:246.735302209854
CID:1692340
PubChem ID:16749212
Update Time:2025-04-21

4-(4-(tert-butyl)phenyl)-6-chloropyrimidine Chemical and Physical Properties

Names and Identifiers

    • Pyrimidine, 4-chloro-6-[4-(1,1-dimethylethyl)phenyl]-
    • 4-(4-tert-Butyl-phenyl)-6-chloro-pyrimidine
    • 4-(4-(tert-butyl)phenyl)-6-chloropyrimidine
    • AKOS014986905
    • AYEOWXKDBGSQAG-UHFFFAOYSA-N
    • DA-03859
    • SCHEMBL1013500
    • HS-3152
    • 4-(4-tert-butylphenyl)-6-chloropyrimidine
    • F1967-3830
    • 659729-07-4
    • Inchi: 1S/C14H15ClN2/c1-14(2,3)11-6-4-10(5-7-11)12-8-13(15)17-9-16-12/h4-9H,1-3H3
    • InChI Key: AYEOWXKDBGSQAG-UHFFFAOYSA-N
    • SMILES: ClC1=CC(C2C=CC(=CC=2)C(C)(C)C)=NC=N1

Computed Properties

  • Exact Mass: 246.09255
  • Monoisotopic Mass: 246.0923762g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 241
  • 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: 4.5
  • Topological Polar Surface Area: 25.8?2

Experimental Properties

  • PSA: 25.78

4-(4-(tert-butyl)phenyl)-6-chloropyrimidine Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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T241676-100mg
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$ 95.00 2022-06-03
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