Cas no 89346-80-5 (Benzene, 1-nitro-4-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]-)

Benzene, 1-nitro-4-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]- structure
89346-80-5 structure
Product Name:Benzene, 1-nitro-4-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]-
CAS No:89346-80-5
MF:C20H25NO7
MW:391.415006399155
CID:603554
PubChem ID:13270654
Update Time:2025-04-19

Benzene, 1-nitro-4-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1-nitro-4-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]-
    • 1-nitro-4-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]benzene
    • 89346-80-5
    • DTXSID40533564
    • 1-NITRO-4-(2-{2-[2-(2-PHENOXYETHOXY)ETHOXY]ETHOXY}ETHOXY)BENZENE
    • Inchi： 1S/C20H25NO7/c22-21(23)18-6-8-20(9-7-18)28-17-15-26-13-11-24-10-12-25-14-16-27-19-4-2-1-3-5-19/h1-9H,10-17H2
    • InChI Key： HBJHYSPCZDSPOS-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: 391
  • 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: 2.4
  • Topological Polar Surface Area: 92?2

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