Cas no 307531-90-4 (Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)-)

Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)- structure
307531-90-4 structure
Product Name:Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)-
CAS No:307531-90-4
MF:C32H74O13Si8
MW:891.606178760529
MDL:MFCD04975248
CID:300421
PubChem ID:5071479
Update Time:2024-10-31

Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)- Chemical and Physical Properties

Names and Identifiers

    • Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)-
    • (i-Bu)8(Si8O11)(OH)2
    • DiSilanolIsobutyl POSS
    • 1,3,5,7,9,11,13,15-Octaisobutyl-2,4,6,8,10,12,14,16,17,18,19-undecaoxa-1,3,5,7,9,11,13,15-octasilatetracyclo[9.5.1.13,9.15,15]nonadecane-7,13-diol
    • 1 3 5 7 9 11-OCTAISOBUTYLTETRACYCLO
    • CS-0435357
    • 307531-90-4
    • 7,13-Dihydroxy-1,3,5,7,9,11,13,15-octakis(2-methylpropyl)-2,4,6,8,10,12,14,16,17,18,19-undecaoxa-1,3,5,7,9,11,13,15-octasilatetracyclo[9.5.1.13,9.15,15]nonadecane
    • MFCD04975248
    • ZJILJEYGMBWQKZ-UHFFFAOYSA-N
    • starbld0006807
    • MDL: MFCD04975248
    • Inchi: InChI=1S/C32H74O13Si8/c1-25(2)17-46(33)35-48(19-27(5)6)39-50(21-29(9)10)37-47(34,18-26(3)4)38-51(22-30(11)12)40-49(36-46,20-28(7)8)42-52(41-48,23-31(13)14)45-53(43-50,44-51)24-32(15)16/h25-34H,17-24H2,1-16H3
    • InChI Key: ZJILJEYGMBWQKZ-UHFFFAOYSA-N
    • SMILES: C([Si]12O[Si]3(O[Si](O)(CC(C)C)O[Si](O[Si]4(O[Si](O)(CC(C)C)O[Si](CC(C)C)(O3)O[Si](O4)(CC(C)C)O1)CC(C)C)(CC(C)C)O2)CC(C)C)C(C)C

Computed Properties

  • Exact Mass: 890.32835469g/mol
  • Monoisotopic Mass: 890.32835469g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 53
  • Rotatable Bond Count: 16
  • Complexity: 1090
  • 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
  • Topological Polar Surface Area: 142?2

Experimental Properties

  • Color/Form: solid
  • Melting Point: 85-89?°C (lit.)
  • PSA: 141.99000
  • LogP: 7.96720
  • Solubility: Not determined

Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)- Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • TSCA:No

Tetracyclo[9.5.1.13,9.15,15]octasiloxane-7,13-diol,1,3,5,7,9,11,13,15-octakis(2-methylpropyl)- Pricemore >>

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