Cas no 134637-67-5 ((((4,6-Dinitro-1,3-phenylene)bis(oxy))bis(methylene))dibenzene)

(((4,6-Dinitro-1,3-phenylene)bis(oxy))bis(methylene))dibenzene structure
134637-67-5 structure
Product Name:(((4,6-Dinitro-1,3-phenylene)bis(oxy))bis(methylene))dibenzene
CAS No:134637-67-5
MF:C20H16N2O6
MW:380.350845336914
CID:105846
PubChem ID:2762780
Update Time:2025-04-18

(((4,6-Dinitro-1,3-phenylene)bis(oxy))bis(methylene))dibenzene Chemical and Physical Properties

Names and Identifiers

    • (((4,6-Dinitro-1,3-phenylene)bis(oxy))bis(methylene))dibenzene
    • 1,3-DIBENZYLOXY-4,6-DINITROBENZENE
    • 1,5-dinitro-2,4-bis(phenylmethoxy)benzene
    • Benzene,1,5-dinitro-2,4-bis(phenylmethoxy)-
    • FKDPHGNSRWHEKI-UHFFFAOYSA-N
    • FT-0709672
    • AKOS015909204
    • SCHEMBL7116860
    • 134637-67-5
    • DTXSID50376444
    • (4,6-dinitro-1,3-phenylene)bis(oxy)bis(methylene)dibenzene
    • Inchi: 1S/C20H16N2O6/c23-21(24)17-11-18(22(25)26)20(28-14-16-9-5-2-6-10-16)12-19(17)27-13-15-7-3-1-4-8-15/h1-12H,13-14H2
    • InChI Key: FKDPHGNSRWHEKI-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1C=C(C(=CC=1[N+](=O)[O-])[N+](=O)[O-])OCC1C=CC=CC=1

Computed Properties

  • Exact Mass: 380.10100
  • Monoisotopic Mass: 380.10083623g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 6
  • Complexity: 464
  • 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: 4.5
  • Topological Polar Surface Area: 110?2

Experimental Properties

  • PSA: 110.10000
  • LogP: 5.70740
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