methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane

C12H40O12Si8 — CID 123246826

IUPACmethyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane
SMILESCCO[Si]1(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O1
InChIInChI=1S/C12H40O12Si8/c1-9-13-29(17-25-5)21-30(14-10-2,18-26-6)23-32(16-12-4,20-28-8)24-31(22-29,15-11-3)19-27-7/h9-12,25-28H2,1-8H3
InChIKeyAJOOOWPFUYTDPY-UHFFFAOYSA-N
MW601.13 g/mol
LogP-1.45
Rot. Bonds16

About methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane

methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane (PubChem CID 123246826) has the molecular formula C12H40O12Si8 and a molecular weight of 601.13 g/mol. Its IUPAC name is methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane.

Molecular Properties

Compound Namemethyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane
PubChem CID123246826
Molecular FormulaC12H40O12Si8
Molecular Weight601.13 g/mol
Exact Mass600.07
IUPAC Namemethyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane
SMILESCCO[Si]1(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O1
InChIInChI=1S/C12H40O12Si8/c1-9-13-29(17-25-5)21-30(14-10-2,18-26-6)23-32(16-12-4,20-28-8)24-31(22-29,15-11-3)19-27-7/h9-12,25-28H2,1-8H3
InChIKeyAJOOOWPFUYTDPY-UHFFFAOYSA-N
XLogP-1.45
TPSA110.76 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds16
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500601.13
LogP ≤ 5-1.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane with MolForge

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Related Compounds

3,3,6,6-tetraethoxy-1,2,4,5,3,6-tetraoxadisilinane
CID 11066533
2,2,4,4-tetraethoxy-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 173268693
CID 136832623
CID 136832623
[1,3,5,7,9,11,14-heptamethyl-7,14-bis(methylsilyloxy)-2,4,6,8,10,12,13,15,16-nonaoxa-1,3,5,7,9,11,14-heptasilatricyclo[7.3.3.15,11]hexadecan-3-yl]oxy-methylsilane;methane
CID 161330789
2,2-diethoxyoxasilirane
CID 140622651
2,2,7,7-tetraethoxy-3,6-dihydro-1,2,7-oxadisilepine
CID 100950891
2,2-diethoxy-4,4-dimethyl-1,3,2-dioxasilinane
CID 13268656
2,5-diethoxy-2,5-dimethyl-1,4,2,5-dioxadisilinane
CID 90308478
methoxy(methyl)silane;propane
CID 123732406
2,2,4,4,6,6-hexamethyl-1,3,5,2,4,6-trioxatrisilinane;methyl(methylsilyloxy)silane
CID 157123096
1,4-diethoxy-1,4-dimethyl-1,4-disilinane
CID 140867723
2-ethoxy-2,4-dimethyl-1,3,2-dioxasiletane
CID 153467726

Frequently Asked Questions

What is the IUPAC name of methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane?
The IUPAC name of methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane (CID 123246826) is methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane.
What is the SMILES notation for methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane?
The canonical SMILES for methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane is CCO[Si]1(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O[Si](OCC)(O[SiH2]C)O1.
What is the InChIKey of methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane?
The InChIKey is AJOOOWPFUYTDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H40O12Si8/c1-9-13-29(17-25-5)21-30(14-10-2,18-26-6)23-32(16-12-4,20-28-8)24-31(22-29,15-11-3)19-27-7/h9-12,25-28H2,1-8H3.
What are the key properties of methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane?
methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane has a molecular weight of 601.13 g/mol, XLogP of -1.45, 16 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[[2,4,6,8-tetraethoxy-4,6,8-tris(methylsilyloxy)-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]oxy]silane is sourced from PubChem (CID 123246826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).