Cas no 147608-57-9 (Phosphonic acid, [(2-hydroxy-3-methyl-5-nitrophenyl)methyl]-)

Phosphonic acid, [(2-hydroxy-3-methyl-5-nitrophenyl)methyl]- structure
147608-57-9 structure
Product Name:Phosphonic acid, [(2-hydroxy-3-methyl-5-nitrophenyl)methyl]-
CAS No:147608-57-9
MF:C8H10NO6P
MW:247.1418633461
CID:1318839
Update Time:2024-08-18

Phosphonic acid, [(2-hydroxy-3-methyl-5-nitrophenyl)methyl]- Chemical and Physical Properties

Names and Identifiers

    • Phosphonic acid, [(2-hydroxy-3-methyl-5-nitrophenyl)methyl]-
    • Phosphonic acid, P-[(2-hydroxy-3-methyl-5-nitrophenyl)methyl]-
    • Inchi: 1S/C8H10NO6P/c1-5-2-7(9(11)12)3-6(8(5)10)4-16(13,14)15/h2-3,10H,4H2,1H3,(H2,13,14,15)
    • InChI Key: WYQHZTQBFXCDCR-UHFFFAOYSA-N
    • SMILES: P(CC1=CC([N+]([O-])=O)=CC(C)=C1O)(=O)(O)O

Computed Properties

  • Exact Mass: 247.0246

Experimental Properties

  • Density: 1.631±0.06 g/cm3(Predicted)
  • Boiling Point: 570.5±60.0 °C(Predicted)
  • PSA: 120.9
  • pka: 1.91±0.10(Predicted)

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