Cas no 140166-86-5 (1H-1,2,4-Triazole, 3-(methoxymethyl)-5-propyl-)

1H-1,2,4-Triazole, 3-(methoxymethyl)-5-propyl- structure
140166-86-5 structure
Product Name:1H-1,2,4-Triazole, 3-(methoxymethyl)-5-propyl-
CAS No:140166-86-5
MF:C7H13N3O
MW:155.197621107101
CID:1284246
Update Time:2024-08-03

1H-1,2,4-Triazole, 3-(methoxymethyl)-5-propyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-1,2,4-Triazole, 3-(methoxymethyl)-5-propyl-
    • 1H-1,2,4-Triazole, 5-(methoxymethyl)-3-propyl-
    • Inchi: 1S/C7H13N3O/c1-3-4-6-8-7(5-11-2)10-9-6/h3-5H2,1-2H3,(H,8,9,10)
    • InChI Key: KADBNDYTGPDBBC-UHFFFAOYSA-N
    • SMILES: N1C(COC)=NC(CCC)=N1

Computed Properties

  • Exact Mass: 155.10599

Experimental Properties

  • Density: 1.087±0.06 g/cm3(Predicted)
  • Boiling Point: 297.7±23.0 °C(Predicted)
  • PSA: 50.8
  • pka: 10.06±0.40(Predicted)
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