3,5-bis(triethylsilyloxy)phenol

C18H34O3Si2 — CID 100933791

IUPAC3,5-bis(triethylsilyloxy)phenol
SMILESCC[Si](CC)(CC)Oc1cc(O)cc(O[Si](CC)(CC)CC)c1
InChIInChI=1S/C18H34O3Si2/c1-7-22(8-2,9-3)20-17-13-16(19)14-18(15-17)21-23(10-4,11-5)12-6/h13-15,19H,7-12H2,1-6H3
InChIKeyGQAADVBDIGCEAN-UHFFFAOYSA-N
MW354.64 g/mol
LogP6.16
Rot. Bonds10

About 3,5-bis(triethylsilyloxy)phenol

3,5-bis(triethylsilyloxy)phenol (PubChem CID 100933791) has the molecular formula C18H34O3Si2 and a molecular weight of 354.64 g/mol. Its IUPAC name is 3,5-bis(triethylsilyloxy)phenol.

Molecular Properties

Compound Name3,5-bis(triethylsilyloxy)phenol
PubChem CID100933791
Molecular FormulaC18H34O3Si2
Molecular Weight354.64 g/mol
Exact Mass354.20
IUPAC Name3,5-bis(triethylsilyloxy)phenol
SMILESCC[Si](CC)(CC)Oc1cc(O)cc(O[Si](CC)(CC)CC)c1
InChIInChI=1S/C18H34O3Si2/c1-7-22(8-2,9-3)20-17-13-16(19)14-18(15-17)21-23(10-4,11-5)12-6/h13-15,19H,7-12H2,1-6H3
InChIKeyGQAADVBDIGCEAN-UHFFFAOYSA-N
XLogP6.16
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.64
LogP ≤ 56.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,5-bis(triethylsilyloxy)phenol?
The IUPAC name of 3,5-bis(triethylsilyloxy)phenol (CID 100933791) is 3,5-bis(triethylsilyloxy)phenol.
What is the SMILES notation for 3,5-bis(triethylsilyloxy)phenol?
The canonical SMILES for 3,5-bis(triethylsilyloxy)phenol is CC[Si](CC)(CC)Oc1cc(O)cc(O[Si](CC)(CC)CC)c1.
What is the InChIKey of 3,5-bis(triethylsilyloxy)phenol?
The InChIKey is GQAADVBDIGCEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O3Si2/c1-7-22(8-2,9-3)20-17-13-16(19)14-18(15-17)21-23(10-4,11-5)12-6/h13-15,19H,7-12H2,1-6H3.
What are the key properties of 3,5-bis(triethylsilyloxy)phenol?
3,5-bis(triethylsilyloxy)phenol has a molecular weight of 354.64 g/mol, XLogP of 6.16, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(triethylsilyloxy)phenol is sourced from PubChem (CID 100933791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).