Cas no 84332-00-3 (Methyl 4-methoxypyrimidine-5-carboxylate)

Methyl 4-methoxypyrimidine-5-carboxylate structure
84332-00-3 structure
Product Name:Methyl 4-methoxypyrimidine-5-carboxylate
CAS No:84332-00-3
MF:C7H8N2O3
MW:168.15002155304
CID:2169661
Update Time:2024-10-26

Methyl 4-methoxypyrimidine-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-methoxypyrimidine-5-carboxylate
    • Inchi: 1S/C7H8N2O3/c1-11-6-5(7(10)12-2)3-8-4-9-6/h3-4H,1-2H3
    • InChI Key: FJEOITPIPJMBNN-UHFFFAOYSA-N
    • SMILES: O=C(C1C(OC)=NC=NC=1)OC

Computed Properties

  • Exact Mass: 168.05300
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3

Experimental Properties

  • Density: 1.220±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 50 oC
  • Boiling Point: 277.8±20.0 oC (760 Torr),
  • Flash Point: 121.8±21.8 oC,
  • Solubility: Dissolution (57 g/l) (25 o C),
  • PSA: 61.31000
  • LogP: 0.27180

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Methyl 4-methoxypyrimidine-5-carboxylate Production Method

Production Method 1

Reaction Conditions
Reference
Studies on the neuroleptic benzamides. I. Synthesis and antidopaminergic properties of new pyrimidine derivatives
Dostert, P.; et al, European Journal of Medicinal Chemistry, 1982, 17(5), 437-44

Methyl 4-methoxypyrimidine-5-carboxylate Raw materials

Methyl 4-methoxypyrimidine-5-carboxylate Preparation Products

Methyl 4-methoxypyrimidine-5-carboxylate Related Literature

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