Cas no 89346-79-2 (Benzene, 1-nitro-2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]-)

Benzene, 1-nitro-2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]- structure
89346-79-2 structure
Product Name:Benzene, 1-nitro-2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]-
CAS No:89346-79-2
MF:C20H25NO7
MW:391.415006399155
CID:603555
PubChem ID:13270653
Update Time:2025-04-19

Benzene, 1-nitro-2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1-nitro-2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]-
    • 1-nitro-2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]benzene
    • 89346-79-2
    • 1-NITRO-2-(2-{2-[2-(2-PHENOXYETHOXY)ETHOXY]ETHOXY}ETHOXY)BENZENE
    • DTXSID80533563
    • Inchi: 1S/C20H25NO7/c22-21(23)19-8-4-5-9-20(19)28-17-15-26-13-11-24-10-12-25-14-16-27-18-6-2-1-3-7-18/h1-9H,10-17H2
    • InChI Key: WNPARDJXBGZTLF-UHFFFAOYSA-N
    • SMILES: O(CCOCCOC1C=CC=CC=1)CCOCCOC1C=CC=CC=1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 391.16310214g/mol
  • Monoisotopic Mass: 391.16310214g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 14
  • Complexity: 399
  • 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
  • XLogP3: 2.9
  • Topological Polar Surface Area: 92?2
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