Cas no 1450822-23-7 (4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)-)

4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)- structure
1450822-23-7 structure
Product Name:4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)-
CAS No:1450822-23-7
MF:C7H11N3O2S
MW:201.246139764786
CID:6626881
Update Time:2024-01-13

4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)- Chemical and Physical Properties

Names and Identifiers

    • 4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)-
    • Inchi: 1S/C7H11N3O2S/c1-3-8-6-4-7(10-5-9-6)13(2,11)12/h4-5H,3H2,1-2H3,(H,8,9,10)
    • InChI Key: VASKXYSNWKIMED-UHFFFAOYSA-N
    • SMILES: C1=NC(S(C)(=O)=O)=CC(NCC)=N1

Experimental Properties

  • Density: 1.310±0.06 g/cm3(Predicted)
  • Boiling Point: 447.1±45.0 °C(Predicted)
  • pka: 1.00±0.10(Predicted)

4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)- Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: m-Chloroperbenzoic acid Solvents: Dichloromethane ;  20 h, 0 °C → rt
2.1 Solvents: Tetrahydrofuran ;  70 min, -70 °C → rt
Reference
Chemoselective reactions of 4,6-dichloro-2-(methylsulfonyl)pyrimidine and related electrophiles with amines
Baiazitov, Ramil; et al, Synthesis, 2013, 45(13), 1764-1784

Production Method 2

Reaction Conditions
1.1 Solvents: Tetrahydrofuran ;  70 min, -70 °C → rt
Reference
Chemoselective reactions of 4,6-dichloro-2-(methylsulfonyl)pyrimidine and related electrophiles with amines
Baiazitov, Ramil; et al, Synthesis, 2013, 45(13), 1764-1784

4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)- Raw materials

4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)- Preparation Products

4-Pyrimidinamine, N-ethyl-6-(methylsulfonyl)- Related Literature

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