ethoxy-(naphthalen-1-ylmethoxy)-propylsilane

C16H22O2Si — CID 154001301

IUPACethoxy-(naphthalen-1-ylmethoxy)-propylsilane
SMILESCCC[SiH](OCC)OCc1cccc2ccccc12
InChIInChI=1S/C16H22O2Si/c1-3-12-19(17-4-2)18-13-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,19H,3-4,12-13H2,1-2H3
InChIKeyBSVLWONFOBWLNG-UHFFFAOYSA-N
MW274.44 g/mol
LogP4.02
Rot. Bonds7

About ethoxy-(naphthalen-1-ylmethoxy)-propylsilane

ethoxy-(naphthalen-1-ylmethoxy)-propylsilane (PubChem CID 154001301) has the molecular formula C16H22O2Si and a molecular weight of 274.44 g/mol. Its IUPAC name is ethoxy-(naphthalen-1-ylmethoxy)-propylsilane.

Molecular Properties

Compound Nameethoxy-(naphthalen-1-ylmethoxy)-propylsilane
PubChem CID154001301
Molecular FormulaC16H22O2Si
Molecular Weight274.44 g/mol
Exact Mass274.14
IUPAC Nameethoxy-(naphthalen-1-ylmethoxy)-propylsilane
SMILESCCC[SiH](OCC)OCc1cccc2ccccc12
InChIInChI=1S/C16H22O2Si/c1-3-12-19(17-4-2)18-13-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,19H,3-4,12-13H2,1-2H3
InChIKeyBSVLWONFOBWLNG-UHFFFAOYSA-N
XLogP4.02
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.44
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 ethoxy-(naphthalen-1-ylmethoxy)-propylsilane?
The IUPAC name of ethoxy-(naphthalen-1-ylmethoxy)-propylsilane (CID 154001301) is ethoxy-(naphthalen-1-ylmethoxy)-propylsilane.
What is the SMILES notation for ethoxy-(naphthalen-1-ylmethoxy)-propylsilane?
The canonical SMILES for ethoxy-(naphthalen-1-ylmethoxy)-propylsilane is CCC[SiH](OCC)OCc1cccc2ccccc12.
What is the InChIKey of ethoxy-(naphthalen-1-ylmethoxy)-propylsilane?
The InChIKey is BSVLWONFOBWLNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O2Si/c1-3-12-19(17-4-2)18-13-15-10-7-9-14-8-5-6-11-16(14)15/h5-11,19H,3-4,12-13H2,1-2H3.
What are the key properties of ethoxy-(naphthalen-1-ylmethoxy)-propylsilane?
ethoxy-(naphthalen-1-ylmethoxy)-propylsilane has a molecular weight of 274.44 g/mol, XLogP of 4.02, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(naphthalen-1-ylmethoxy)-propylsilane is sourced from PubChem (CID 154001301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).