tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane

C16H26O2Si — CID 86205283

IUPACtert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane
SMILESC=CCc1ccc(O[Si](C)(C)C(C)(C)C)c(OC)c1
InChIInChI=1S/C16H26O2Si/c1-8-9-13-10-11-14(15(12-13)17-5)18-19(6,7)16(2,3)4/h8,10-12H,1,9H2,2-7H3
InChIKeyMEEHQQWUCCAYSY-UHFFFAOYSA-N
MW278.47 g/mol
LogP4.81
Rot. Bonds5

About tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane

tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane (PubChem CID 86205283) has the molecular formula C16H26O2Si and a molecular weight of 278.47 g/mol. Its IUPAC name is tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane
PubChem CID86205283
Molecular FormulaC16H26O2Si
Molecular Weight278.47 g/mol
Exact Mass278.17
IUPAC Nametert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane
SMILESC=CCc1ccc(O[Si](C)(C)C(C)(C)C)c(OC)c1
InChIInChI=1S/C16H26O2Si/c1-8-9-13-10-11-14(15(12-13)17-5)18-19(6,7)16(2,3)4/h8,10-12H,1,9H2,2-7H3
InChIKeyMEEHQQWUCCAYSY-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane (CID 86205283) is tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane is C=CCc1ccc(O[Si](C)(C)C(C)(C)C)c(OC)c1.
What is the InChIKey of tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane?
The InChIKey is MEEHQQWUCCAYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O2Si/c1-8-9-13-10-11-14(15(12-13)17-5)18-19(6,7)16(2,3)4/h8,10-12H,1,9H2,2-7H3.
What are the key properties of tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane?
tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane has a molecular weight of 278.47 g/mol, XLogP of 4.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-methoxy-4-prop-2-enylphenoxy)-dimethylsilane is sourced from PubChem (CID 86205283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).