triethoxy(1-naphthalen-2-ylethyl)silane

C18H26O3Si — CID 18795115

IUPACtriethoxy(1-naphthalen-2-ylethyl)silane
SMILESCCO[Si](OCC)(OCC)C(C)c1ccc2ccccc2c1
InChIInChI=1S/C18H26O3Si/c1-5-19-22(20-6-2,21-7-3)15(4)17-13-12-16-10-8-9-11-18(16)14-17/h8-15H,5-7H2,1-4H3
InChIKeyHICOLXJBMVTWRW-UHFFFAOYSA-N
MW318.49 g/mol
LogP4.53
Rot. Bonds8

About triethoxy(1-naphthalen-2-ylethyl)silane

triethoxy(1-naphthalen-2-ylethyl)silane (PubChem CID 18795115) has the molecular formula C18H26O3Si and a molecular weight of 318.49 g/mol. Its IUPAC name is triethoxy(1-naphthalen-2-ylethyl)silane.

Molecular Properties

Compound Nametriethoxy(1-naphthalen-2-ylethyl)silane
PubChem CID18795115
Molecular FormulaC18H26O3Si
Molecular Weight318.49 g/mol
Exact Mass318.17
IUPAC Nametriethoxy(1-naphthalen-2-ylethyl)silane
SMILESCCO[Si](OCC)(OCC)C(C)c1ccc2ccccc2c1
InChIInChI=1S/C18H26O3Si/c1-5-19-22(20-6-2,21-7-3)15(4)17-13-12-16-10-8-9-11-18(16)14-17/h8-15H,5-7H2,1-4H3
InChIKeyHICOLXJBMVTWRW-UHFFFAOYSA-N
XLogP4.53
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.49
LogP ≤ 54.53
H-Bond Donors ≤ 50
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 triethoxy(1-naphthalen-2-ylethyl)silane?
The IUPAC name of triethoxy(1-naphthalen-2-ylethyl)silane (CID 18795115) is triethoxy(1-naphthalen-2-ylethyl)silane.
What is the SMILES notation for triethoxy(1-naphthalen-2-ylethyl)silane?
The canonical SMILES for triethoxy(1-naphthalen-2-ylethyl)silane is CCO[Si](OCC)(OCC)C(C)c1ccc2ccccc2c1.
What is the InChIKey of triethoxy(1-naphthalen-2-ylethyl)silane?
The InChIKey is HICOLXJBMVTWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O3Si/c1-5-19-22(20-6-2,21-7-3)15(4)17-13-12-16-10-8-9-11-18(16)14-17/h8-15H,5-7H2,1-4H3.
What are the key properties of triethoxy(1-naphthalen-2-ylethyl)silane?
triethoxy(1-naphthalen-2-ylethyl)silane has a molecular weight of 318.49 g/mol, XLogP of 4.53, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(1-naphthalen-2-ylethyl)silane is sourced from PubChem (CID 18795115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).