Cas no 31176-12-2 (octyl-Silanetriol)

octyl-Silanetriol structure
octyl-Silanetriol structure
Product Name:octyl-Silanetriol
CAS No:31176-12-2
MF:C8H20O3Si
MW:192.328104019165
CID:1445487
PubChem ID:11564621
Update Time:2025-08-04

octyl-Silanetriol Chemical and Physical Properties

Names and Identifiers

    • octyl-Silanetriol
    • Silanetriol, octyl-
    • trihydroxy(octyl)silane
    • DTXSID10468657
    • 31176-12-2
    • octyltrihydroxysilane
    • octylsilanetriol
    • SCHEMBL1687052
    • Inchi: 1S/C8H20O3Si/c1-2-3-4-5-6-7-8-12(9,10)11/h9-11H,2-8H2,1H3
    • InChI Key: YLZZRAHVHXTKGO-UHFFFAOYSA-N
    • SMILES: [Si](CCCCCCCC)(O)(O)O

Computed Properties

  • Exact Mass: 192.1182
  • Monoisotopic Mass: 192.11817103g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 7
  • Complexity: 101
  • 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
  • Topological Polar Surface Area: 60.7?2

Experimental Properties

  • PSA: 60.69

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