Cas no 614729-28-1 (4-(Tert-Butoxy)-2-chloropyrimidine)

4-(Tert-Butoxy)-2-chloropyrimidine structure
614729-28-1 structure
Product Name:4-(Tert-Butoxy)-2-chloropyrimidine
CAS No:614729-28-1
MF:C8H11ClN2O
MW:186.638740777969
MDL:MFCD16712391
CID:1057205
PubChem ID:22248318
Update Time:2025-04-20

4-(Tert-Butoxy)-2-chloropyrimidine Chemical and Physical Properties

Names and Identifiers

    • 4-(tert-Butoxy)-2-chloropyrimidine
    • Pyrimidine, 2-?chloro-?4-?(1,?1-?dimethylethoxy)?-
    • Pyrimidine, 2-chloro-4-(1,1-dimethylethoxy)-
    • 4-tert-butoxy-2-chloropyrimidine
    • PZFBNKHDNDRSQO-UHFFFAOYSA-N
    • 6017AJ
    • TRA0021857
    • SY020554
    • 2-chloro-4-[(2-methylpropan-2-yl)oxy]pyrimidine
    • AKOS011623094
    • 2-Chloro-4-(tert-butoxy)pyrimidine
    • AS-32629
    • DB-367094
    • DTXSID201270315
    • SCHEMBL1474718
    • MFCD16712391
    • A868705
    • SB56038
    • 614729-28-1
    • AC-25605
    • 2-Chloro-4-(1,1-dimethylethoxy)pyrimidine
    • AMY20320
    • 4-(Tert-Butoxy)-2-chloropyrimidine
    • MDL: MFCD16712391
    • Inchi: 1S/C8H11ClN2O/c1-8(2,3)12-6-4-5-10-7(9)11-6/h4-5H,1-3H3
    • InChI Key: PZFBNKHDNDRSQO-UHFFFAOYSA-N
    • SMILES: ClC1=NC=CC(=N1)OC(C)(C)C

Computed Properties

  • Exact Mass: 186.05600
  • Monoisotopic Mass: 186.0559907g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 147
  • 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: 35
  • XLogP3: 2.5

Experimental Properties

  • PSA: 35.01000
  • LogP: 2.30730

4-(Tert-Butoxy)-2-chloropyrimidine Pricemore >>

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abcr
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