[dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate

C18H54O12Si8 — CID 22942624

IUPAC[dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate
SMILESCO[Si](C)(OC)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](OC)(OC)O[Si](OC)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H54O12Si8/c1-19-35(18,20-2)28-38(26-33(12,13)14,27-34(15,16)17)30-36(21-3,22-4)29-37(23-5,24-31(6,7)8)25-32(9,10)11/h1-18H3
InChIKeyWEOJRASFEIXFDD-UHFFFAOYSA-N
MW687.31 g/mol
LogP4.55
Rot. Bonds19

About [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate

[dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate (PubChem CID 22942624) has the molecular formula C18H54O12Si8 and a molecular weight of 687.31 g/mol. Its IUPAC name is [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate.

Molecular Properties

Compound Name[dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate
PubChem CID22942624
Molecular FormulaC18H54O12Si8
Molecular Weight687.31 g/mol
Exact Mass686.18
IUPAC Name[dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate
SMILESCO[Si](C)(OC)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](OC)(OC)O[Si](OC)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H54O12Si8/c1-19-35(18,20-2)28-38(26-33(12,13)14,27-34(15,16)17)30-36(21-3,22-4)29-37(23-5,24-31(6,7)8)25-32(9,10)11/h1-18H3
InChIKeyWEOJRASFEIXFDD-UHFFFAOYSA-N
XLogP4.55
TPSA110.76 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds19
Heavy Atoms38
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500687.31
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate?
The IUPAC name of [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate (CID 22942624) is [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate.
What is the SMILES notation for [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate?
The canonical SMILES for [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate is CO[Si](C)(OC)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](OC)(OC)O[Si](OC)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate?
The InChIKey is WEOJRASFEIXFDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H54O12Si8/c1-19-35(18,20-2)28-38(26-33(12,13)14,27-34(15,16)17)30-36(21-3,22-4)29-37(23-5,24-31(6,7)8)25-32(9,10)11/h1-18H3.
What are the key properties of [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate?
[dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate has a molecular weight of 687.31 g/mol, XLogP of 4.55, 19 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxy-[methoxy-bis(trimethylsilyloxy)silyl]oxysilyl] [dimethoxy(methyl)silyl] bis(trimethylsilyl) silicate is sourced from PubChem (CID 22942624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).