trimethyl(octadecyl)silane

C21H46Si — CID 552292

IUPACtrimethyl(octadecyl)silane
SMILESCCCCCCCCCCCCCCCCCC[Si](C)(C)C
InChIInChI=1S/C21H46Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4/h5-21H2,1-4H3
InChIKeyAXJAWMUPFHKOHY-UHFFFAOYSA-N
MW326.69 g/mol
LogP8.59
Rot. Bonds17

About trimethyl(octadecyl)silane

trimethyl(octadecyl)silane (PubChem CID 552292) has the molecular formula C21H46Si and a molecular weight of 326.69 g/mol. Its IUPAC name is trimethyl(octadecyl)silane.

Molecular Properties

Compound Nametrimethyl(octadecyl)silane
PubChem CID552292
Molecular FormulaC21H46Si
Molecular Weight326.69 g/mol
Exact Mass326.34
IUPAC Nametrimethyl(octadecyl)silane
SMILESCCCCCCCCCCCCCCCCCC[Si](C)(C)C
InChIInChI=1S/C21H46Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4/h5-21H2,1-4H3
InChIKeyAXJAWMUPFHKOHY-UHFFFAOYSA-N
XLogP8.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.69
LogP ≤ 58.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 trimethyl(octadecyl)silane?
The IUPAC name of trimethyl(octadecyl)silane (CID 552292) is trimethyl(octadecyl)silane.
What is the SMILES notation for trimethyl(octadecyl)silane?
The canonical SMILES for trimethyl(octadecyl)silane is CCCCCCCCCCCCCCCCCC[Si](C)(C)C.
What is the InChIKey of trimethyl(octadecyl)silane?
The InChIKey is AXJAWMUPFHKOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4/h5-21H2,1-4H3.
What are the key properties of trimethyl(octadecyl)silane?
trimethyl(octadecyl)silane has a molecular weight of 326.69 g/mol, XLogP of 8.59, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(octadecyl)silane is sourced from PubChem (CID 552292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).