tert-butyl-pentoxy-diphenylsilane

C21H30OSi — CID 10925447

IUPACtert-butyl-pentoxy-diphenylsilane
SMILESCCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C21H30OSi/c1-5-6-13-18-22-23(21(2,3)4,19-14-9-7-10-15-19)20-16-11-8-12-17-20/h7-12,14-17H,5-6,13,18H2,1-4H3
InChIKeyPHFWNNBCUHTUTB-UHFFFAOYSA-N
MW326.56 g/mol
LogP4.75
Rot. Bonds7

About tert-butyl-pentoxy-diphenylsilane

tert-butyl-pentoxy-diphenylsilane (PubChem CID 10925447) has the molecular formula C21H30OSi and a molecular weight of 326.56 g/mol. Its IUPAC name is tert-butyl-pentoxy-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-pentoxy-diphenylsilane
PubChem CID10925447
Molecular FormulaC21H30OSi
Molecular Weight326.56 g/mol
Exact Mass326.21
IUPAC Nametert-butyl-pentoxy-diphenylsilane
SMILESCCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C21H30OSi/c1-5-6-13-18-22-23(21(2,3)4,19-14-9-7-10-15-19)20-16-11-8-12-17-20/h7-12,14-17H,5-6,13,18H2,1-4H3
InChIKeyPHFWNNBCUHTUTB-UHFFFAOYSA-N
XLogP4.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.56
LogP ≤ 54.75
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-pentoxy-diphenylsilane?
The IUPAC name of tert-butyl-pentoxy-diphenylsilane (CID 10925447) is tert-butyl-pentoxy-diphenylsilane.
What is the SMILES notation for tert-butyl-pentoxy-diphenylsilane?
The canonical SMILES for tert-butyl-pentoxy-diphenylsilane is CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-pentoxy-diphenylsilane?
The InChIKey is PHFWNNBCUHTUTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30OSi/c1-5-6-13-18-22-23(21(2,3)4,19-14-9-7-10-15-19)20-16-11-8-12-17-20/h7-12,14-17H,5-6,13,18H2,1-4H3.
What are the key properties of tert-butyl-pentoxy-diphenylsilane?
tert-butyl-pentoxy-diphenylsilane has a molecular weight of 326.56 g/mol, XLogP of 4.75, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-pentoxy-diphenylsilane is sourced from PubChem (CID 10925447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).