Cas no 72562-52-8 (1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,8,12,14,18-tetramethyl-)

1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,8,12,14,18-tetramethyl- structure
72562-52-8 structure
Product Name:1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,8,12,14,18-tetramethyl-
CAS No:72562-52-8
MF:C16H28O8
MW:348.388726234436
CID:579507
PubChem ID:326434
Update Time:2025-04-19

1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,8,12,14,18-tetramethyl- Chemical and Physical Properties

Names and Identifiers

    • 1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,8,12,14,18-tetramethyl-
    • 8,12,14,18-tetramethyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
    • AC1L6YCM
    • NSC297855
    • NSC-297855
    • DTXSID80315846
    • 72562-52-8
    • Inchi: 1S/C16H28O8/c1-11-5-19-7-13(3)23-15(17)9-21-10-16(18)24-14(4)8-20-6-12(2)22-11/h11-14H,5-10H2,1-4H3
    • InChI Key: JLSULYALYSWSED-UHFFFAOYSA-N
    • SMILES: O1C(C)COCC(C)OC(COCC(=O)OC(C)COCC1C)=O

Computed Properties

  • Exact Mass: 348.17844
  • Monoisotopic Mass: 348.178
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 0
  • Complexity: 352
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 89.5?2

Experimental Properties

  • Density: 1.029
  • Boiling Point: 520.6°Cat760mmHg
  • Flash Point: 228.6°C
  • Refractive Index: 1.411
  • PSA: 89.52
  • LogP: 0.70680
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