Octavinyloctasilasesquioxane

C16H24O12Si8CAS 69655-76-1633.04 g/mol

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Alkene

Properties

Molecular formula
C16H24O12Si8
Molar mass
633.04 g/mol
Exact mass
631.9422 Da
logP
1.57Crippen estimate
Polar surface area
110.8 Ų
H-bond donors / acceptors
0 / 12
Rotatable bonds
8

Hazards

Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
69655-76-1
SMILES
C=C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)C=C)C=C)C=C)C=C)C=C)C=C)C=C
InChIKey
ZWCNRMDCQDJIRL-UHFFFAOYSA-N
InChI
InChI=1S/C16H24O12Si8/c1-9-29-17-30(10-2)20-33(13-5)22-31(11-3,18-29)24-35(15-7)25-32(12-4,19-29)23-34(14-6,21-30)27-36(16-8,26-33)28-35/h9-16H,1-8H2
Characterization data

Calculated from the structure, in the form journals print them.

¹H NMR
Predicted ¹H NMR (400 MHz, CDCl₃) δ 5.70 (dd, J = 16.8, 10.8 Hz, 8H), 5.03 (dd, J = 16.8, 1.4 Hz, 8H), 4.97 (dd, J = 10.8, 1.4 Hz, 8H).
¹³C NMR
Predicted ¹³C NMR (101 MHz, CDCl₃) δ 140.2, 130.0.
[M + H]+
[M + H]+ Calcd for C16H25O12Si8 632.9495
[M + Na]+
[M + Na]+ Calcd for C16H24NaO12Si8 654.9314
[M − H]−
[M − H]− Calcd for C16H23O12Si8 630.9349
Elemental analysis
Anal. Calcd for C16H24O12Si8: C, 30.36; H, 3.82.

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 name
  • Octavinyl-T8-silsesquioxane

Work with Octavinyloctasilasesquioxane

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere