Cas no 32702-27-5 (1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl-)

1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl- structure
32702-27-5 structure
Product Name:1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl-
CAS No:32702-27-5
MF:C15H22O5
MW:282.332185268402
CID:293774
PubChem ID:591837
Update Time:2025-04-19

1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl- Chemical and Physical Properties

Names and Identifiers

    • 1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl-
    • 4-METHYLBENZO-15-CROWN-5
    • 3-Methyl-2-phosphanaphthalen
    • 3-Methylbenzo<c>phosphorin
    • 3-methyl-benzo-15-crown-5
    • 3-methyl-isophosphinoline
    • 4-methyl-benzo-15-crown-5
    • 4'-Methylbenzo-15-krone-5
    • Isophosphinoline,3-methyl
    • 32702-27-5
    • InChI=1/C15H22O5/c1-13-2-3-14-15(12-13)20-11-9-18-7-5-16-4-6-17-8-10-19-14/h2-3,12H,4-11H2,1H3
    • 18-methyl-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
    • 4'-Methylbenzo-15-crown-5
    • 15-Methyl-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine
    • 15-Methyl-2,3,5,6,8,9,11,12-octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentadecine
    • SCHEMBL11933408
    • HCQGDZNYDMLVRI-UHFFFAOYSA-
    • 15-Methyl-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine #
    • HCQGDZNYDMLVRI-UHFFFAOYSA-N
    • Inchi： 1S/C15H22O5/c1-13-2-3-14-15(12-13)20-11-9-18-7-5-16-4-6-17-8-10-19-14/h2-3,12H,4-11H2,1H3
    • InChI Key： HCQGDZNYDMLVRI-UHFFFAOYSA-N
    • SMILES： O1CCOCCOCCOCCOC2C=CC(C)=CC1=2

Computed Properties

  • Exact Mass: 283.15500
  • Monoisotopic Mass: 282.14672380g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 0
  • Complexity: 248
  • 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: 1
  • Topological Polar Surface Area: 46.2?2

Experimental Properties

  • PSA: 46.15000
  • LogP: 1.67310

1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl- Related Literature

Related Categories

32702-27-5 (1,4,7,10,13-Benzopentaoxacyclopentadecin,2,3,5,6,8,9,11,12-octahydro-15-methyl-) Related Products

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