tributoxysilane

C12H28O3Si — CID 71378232

IUPACtributoxysilane
SMILESCCCCO[SiH](OCCCC)OCCCC
InChIInChI=1S/C12H28O3Si/c1-4-7-10-13-16(14-11-8-5-2)15-12-9-6-3/h16H,4-12H2,1-3H3
InChIKeyUCSBCWBHZLSFGC-UHFFFAOYSA-N
MW248.44 g/mol
LogP3.15
Rot. Bonds12

About tributoxysilane

tributoxysilane (PubChem CID 71378232) has the molecular formula C12H28O3Si and a molecular weight of 248.44 g/mol. Its IUPAC name is tributoxysilane.

Molecular Properties

Compound Nametributoxysilane
PubChem CID71378232
Molecular FormulaC12H28O3Si
Molecular Weight248.44 g/mol
Exact Mass248.18
IUPAC Nametributoxysilane
SMILESCCCCO[SiH](OCCCC)OCCCC
InChIInChI=1S/C12H28O3Si/c1-4-7-10-13-16(14-11-8-5-2)15-12-9-6-3/h16H,4-12H2,1-3H3
InChIKeyUCSBCWBHZLSFGC-UHFFFAOYSA-N
XLogP3.15
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Tetrapropoxysilane
CID 69627
Triethoxysilane
CID 13830
Tributoxymethylsilane
CID 79694
Butoxydiethoxymethylsilane
CID 20365990
Dibutoxyethoxymethylsilane
CID 44146926
Fluorotrinormalpropoxysilane
CID 21903045
Silane, trimethoxy-, butyloxy-
CID 524709
Tripropoxysilane
CID 13783506
Dibutoxy(ethyl)silane
CID 600236
Dibutoxy(methyl)silane
CID 637752
Methyl-di-n-butoxysilane
CID 6334598
Silane, tripropoxy-, butyloxy-
CID 521676

Frequently Asked Questions

What is the IUPAC name of tributoxysilane?
The IUPAC name of tributoxysilane (CID 71378232) is tributoxysilane.
What is the SMILES notation for tributoxysilane?
The canonical SMILES for tributoxysilane is CCCCO[SiH](OCCCC)OCCCC.
What is the InChIKey of tributoxysilane?
The InChIKey is UCSBCWBHZLSFGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O3Si/c1-4-7-10-13-16(14-11-8-5-2)15-12-9-6-3/h16H,4-12H2,1-3H3.
What are the key properties of tributoxysilane?
tributoxysilane has a molecular weight of 248.44 g/mol, XLogP of 3.15, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributoxysilane is sourced from PubChem (CID 71378232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).