tert-butyl-dimethyl-pentadecoxysilane

C21H46OSi — CID 91147733

IUPACtert-butyl-dimethyl-pentadecoxysilane
SMILESCCCCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C21H46OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-23(5,6)21(2,3)4/h7-20H2,1-6H3
InChIKeyGNJGCAHOKODPJB-UHFFFAOYSA-N
MW342.68 g/mol
LogP8.10
Rot. Bonds15

About tert-butyl-dimethyl-pentadecoxysilane

tert-butyl-dimethyl-pentadecoxysilane (PubChem CID 91147733) has the molecular formula C21H46OSi and a molecular weight of 342.68 g/mol. Its IUPAC name is tert-butyl-dimethyl-pentadecoxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-pentadecoxysilane
PubChem CID91147733
Molecular FormulaC21H46OSi
Molecular Weight342.68 g/mol
Exact Mass342.33
IUPAC Nametert-butyl-dimethyl-pentadecoxysilane
SMILESCCCCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C21H46OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-23(5,6)21(2,3)4/h7-20H2,1-6H3
InChIKeyGNJGCAHOKODPJB-UHFFFAOYSA-N
XLogP8.10
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.68
LogP ≤ 58.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 tert-butyl-dimethyl-pentadecoxysilane?
The IUPAC name of tert-butyl-dimethyl-pentadecoxysilane (CID 91147733) is tert-butyl-dimethyl-pentadecoxysilane.
What is the SMILES notation for tert-butyl-dimethyl-pentadecoxysilane?
The canonical SMILES for tert-butyl-dimethyl-pentadecoxysilane is CCCCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-pentadecoxysilane?
The InChIKey is GNJGCAHOKODPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-23(5,6)21(2,3)4/h7-20H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-pentadecoxysilane?
tert-butyl-dimethyl-pentadecoxysilane has a molecular weight of 342.68 g/mol, XLogP of 8.10, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-pentadecoxysilane is sourced from PubChem (CID 91147733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).