2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane

C18H28O2Si — CID 10859695

IUPAC2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane
SMILESCC(=C1CC1)c1ccc(C)cc1OCOCC[Si](C)(C)C
InChIInChI=1S/C18H28O2Si/c1-14-6-9-17(15(2)16-7-8-16)18(12-14)20-13-19-10-11-21(3,4)5/h6,9,12H,7-8,10-11,13H2,1-5H3
InChIKeyYAUNIWPWSIEJNB-UHFFFAOYSA-N
MW304.51 g/mol
LogP5.25
Rot. Bonds7

About 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane

2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane (PubChem CID 10859695) has the molecular formula C18H28O2Si and a molecular weight of 304.51 g/mol. Its IUPAC name is 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane
PubChem CID10859695
Molecular FormulaC18H28O2Si
Molecular Weight304.51 g/mol
Exact Mass304.19
IUPAC Name2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane
SMILESCC(=C1CC1)c1ccc(C)cc1OCOCC[Si](C)(C)C
InChIInChI=1S/C18H28O2Si/c1-14-6-9-17(15(2)16-7-8-16)18(12-14)20-13-19-10-11-21(3,4)5/h6,9,12H,7-8,10-11,13H2,1-5H3
InChIKeyYAUNIWPWSIEJNB-UHFFFAOYSA-N
XLogP5.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.51
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane (CID 10859695) is 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane is CC(=C1CC1)c1ccc(C)cc1OCOCC[Si](C)(C)C.
What is the InChIKey of 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane?
The InChIKey is YAUNIWPWSIEJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O2Si/c1-14-6-9-17(15(2)16-7-8-16)18(12-14)20-13-19-10-11-21(3,4)5/h6,9,12H,7-8,10-11,13H2,1-5H3.
What are the key properties of 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane?
2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane has a molecular weight of 304.51 g/mol, XLogP of 5.25, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1-cyclopropylideneethyl)-5-methylphenoxy]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 10859695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).