Cas no 100392-79-8 (Hexane, 1,6-dipropoxy-)

Hexane, 1,6-dipropoxy- structure
Hexane, 1,6-dipropoxy- structure
Product Name:Hexane, 1,6-dipropoxy-
CAS No:100392-79-8
MF:C12H26O2
MW:202.333644390106
CID:1125717
PubChem ID:13082815
Update Time:2025-04-20

Hexane, 1,6-dipropoxy- Chemical and Physical Properties

Names and Identifiers

    • Hexane, 1,6-dipropoxy-
    • 1,6-dipropoxyhexane
    • SCHEMBL2512982
    • DTXSID00517648
    • 100392-79-8
    • Inchi: 1S/C12H26O2/c1-3-9-13-11-7-5-6-8-12-14-10-4-2/h3-12H2,1-2H3
    • InChI Key: YEPOMPRKROEEFL-UHFFFAOYSA-N
    • SMILES: O(CCC)CCCCCCOCCC

Computed Properties

  • Exact Mass: 202.19338
  • Monoisotopic Mass: 202.193280068g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 11
  • Complexity: 82.3
  • 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: 3.1
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • PSA: 18.46

Hexane, 1,6-dipropoxy- Related Literature

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