triethoxy-(4-prop-2-enylphenyl)silane

C15H24O3Si — CID 66685937

IUPACtriethoxy-(4-prop-2-enylphenyl)silane
SMILESC=CCc1ccc([Si](OCC)(OCC)OCC)cc1
InChIInChI=1S/C15H24O3Si/c1-5-9-14-10-12-15(13-11-14)19(16-6-2,17-7-3)18-8-4/h5,10-13H,1,6-9H2,2-4H3
InChIKeyHHCDQQGBPZBXJN-UHFFFAOYSA-N
MW280.44 g/mol
LogP2.67
Rot. Bonds9

About triethoxy-(4-prop-2-enylphenyl)silane

triethoxy-(4-prop-2-enylphenyl)silane (PubChem CID 66685937) has the molecular formula C15H24O3Si and a molecular weight of 280.44 g/mol. Its IUPAC name is triethoxy-(4-prop-2-enylphenyl)silane.

Molecular Properties

Compound Nametriethoxy-(4-prop-2-enylphenyl)silane
PubChem CID66685937
Molecular FormulaC15H24O3Si
Molecular Weight280.44 g/mol
Exact Mass280.15
IUPAC Nametriethoxy-(4-prop-2-enylphenyl)silane
SMILESC=CCc1ccc([Si](OCC)(OCC)OCC)cc1
InChIInChI=1S/C15H24O3Si/c1-5-9-14-10-12-15(13-11-14)19(16-6-2,17-7-3)18-8-4/h5,10-13H,1,6-9H2,2-4H3
InChIKeyHHCDQQGBPZBXJN-UHFFFAOYSA-N
XLogP2.67
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethoxy-(4-prop-2-enylphenyl)silane?
The IUPAC name of triethoxy-(4-prop-2-enylphenyl)silane (CID 66685937) is triethoxy-(4-prop-2-enylphenyl)silane.
What is the SMILES notation for triethoxy-(4-prop-2-enylphenyl)silane?
The canonical SMILES for triethoxy-(4-prop-2-enylphenyl)silane is C=CCc1ccc([Si](OCC)(OCC)OCC)cc1.
What is the InChIKey of triethoxy-(4-prop-2-enylphenyl)silane?
The InChIKey is HHCDQQGBPZBXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3Si/c1-5-9-14-10-12-15(13-11-14)19(16-6-2,17-7-3)18-8-4/h5,10-13H,1,6-9H2,2-4H3.
What are the key properties of triethoxy-(4-prop-2-enylphenyl)silane?
triethoxy-(4-prop-2-enylphenyl)silane has a molecular weight of 280.44 g/mol, XLogP of 2.67, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-(4-prop-2-enylphenyl)silane is sourced from PubChem (CID 66685937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).