trimethoxy(1-trimethoxysilylhexyl)silane

C12H30O6Si2 — CID 10193369

IUPACtrimethoxy(1-trimethoxysilylhexyl)silane
SMILESCCCCCC([Si](OC)(OC)OC)[Si](OC)(OC)OC
InChIInChI=1S/C12H30O6Si2/c1-8-9-10-11-12(19(13-2,14-3)15-4)20(16-5,17-6)18-7/h12H,8-11H2,1-7H3
InChIKeyJBYXACURRYATNJ-UHFFFAOYSA-N
MW326.54 g/mol
LogP2.23
Rot. Bonds12

About trimethoxy(1-trimethoxysilylhexyl)silane

trimethoxy(1-trimethoxysilylhexyl)silane (PubChem CID 10193369) has the molecular formula C12H30O6Si2 and a molecular weight of 326.54 g/mol. Its IUPAC name is trimethoxy(1-trimethoxysilylhexyl)silane.

Molecular Properties

Compound Nametrimethoxy(1-trimethoxysilylhexyl)silane
PubChem CID10193369
Molecular FormulaC12H30O6Si2
Molecular Weight326.54 g/mol
Exact Mass326.16
IUPAC Nametrimethoxy(1-trimethoxysilylhexyl)silane
SMILESCCCCCC([Si](OC)(OC)OC)[Si](OC)(OC)OC
InChIInChI=1S/C12H30O6Si2/c1-8-9-10-11-12(19(13-2,14-3)15-4)20(16-5,17-6)18-7/h12H,8-11H2,1-7H3
InChIKeyJBYXACURRYATNJ-UHFFFAOYSA-N
XLogP2.23
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.54
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethoxy(1-trimethoxysilylhexyl)silane?
The IUPAC name of trimethoxy(1-trimethoxysilylhexyl)silane (CID 10193369) is trimethoxy(1-trimethoxysilylhexyl)silane.
What is the SMILES notation for trimethoxy(1-trimethoxysilylhexyl)silane?
The canonical SMILES for trimethoxy(1-trimethoxysilylhexyl)silane is CCCCCC([Si](OC)(OC)OC)[Si](OC)(OC)OC.
What is the InChIKey of trimethoxy(1-trimethoxysilylhexyl)silane?
The InChIKey is JBYXACURRYATNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30O6Si2/c1-8-9-10-11-12(19(13-2,14-3)15-4)20(16-5,17-6)18-7/h12H,8-11H2,1-7H3.
What are the key properties of trimethoxy(1-trimethoxysilylhexyl)silane?
trimethoxy(1-trimethoxysilylhexyl)silane has a molecular weight of 326.54 g/mol, XLogP of 2.23, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(1-trimethoxysilylhexyl)silane is sourced from PubChem (CID 10193369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).