(4-benzylphenoxy)-triethylsilane

C19H26OSi — CID 102358049

IUPAC(4-benzylphenoxy)-triethylsilane
SMILESCC[Si](CC)(CC)Oc1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C19H26OSi/c1-4-21(5-2,6-3)20-19-14-12-18(13-15-19)16-17-10-8-7-9-11-17/h7-15H,4-6,16H2,1-3H3
InChIKeyBYNNVXHLNCMIOK-UHFFFAOYSA-N
MW298.50 g/mol
LogP5.66
Rot. Bonds7

About (4-benzylphenoxy)-triethylsilane

(4-benzylphenoxy)-triethylsilane (PubChem CID 102358049) has the molecular formula C19H26OSi and a molecular weight of 298.50 g/mol. Its IUPAC name is (4-benzylphenoxy)-triethylsilane.

Molecular Properties

Compound Name(4-benzylphenoxy)-triethylsilane
PubChem CID102358049
Molecular FormulaC19H26OSi
Molecular Weight298.50 g/mol
Exact Mass298.18
IUPAC Name(4-benzylphenoxy)-triethylsilane
SMILESCC[Si](CC)(CC)Oc1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C19H26OSi/c1-4-21(5-2,6-3)20-19-14-12-18(13-15-19)16-17-10-8-7-9-11-17/h7-15H,4-6,16H2,1-3H3
InChIKeyBYNNVXHLNCMIOK-UHFFFAOYSA-N
XLogP5.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.50
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (4-benzylphenoxy)-triethylsilane?
The IUPAC name of (4-benzylphenoxy)-triethylsilane (CID 102358049) is (4-benzylphenoxy)-triethylsilane.
What is the SMILES notation for (4-benzylphenoxy)-triethylsilane?
The canonical SMILES for (4-benzylphenoxy)-triethylsilane is CC[Si](CC)(CC)Oc1ccc(Cc2ccccc2)cc1.
What is the InChIKey of (4-benzylphenoxy)-triethylsilane?
The InChIKey is BYNNVXHLNCMIOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26OSi/c1-4-21(5-2,6-3)20-19-14-12-18(13-15-19)16-17-10-8-7-9-11-17/h7-15H,4-6,16H2,1-3H3.
What are the key properties of (4-benzylphenoxy)-triethylsilane?
(4-benzylphenoxy)-triethylsilane has a molecular weight of 298.50 g/mol, XLogP of 5.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzylphenoxy)-triethylsilane is sourced from PubChem (CID 102358049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).