tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane

C17H34OSi — CID 24823998

IUPACtert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane
SMILESC=C[C@](C)(CCC=C(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34OSi/c1-10-17(7,13-11-12-15(2)3)14-18-19(8,9)16(4,5)6/h10,12H,1,11,13-14H2,2-9H3/t17-/m1/s1
InChIKeyUELPCXPDBSSHNY-QGZVFWFLSA-N
MW282.54 g/mol
LogP5.95
Rot. Bonds7

About tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane

tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane (PubChem CID 24823998) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane
PubChem CID24823998
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Nametert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane
SMILESC=C[C@](C)(CCC=C(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34OSi/c1-10-17(7,13-11-12-15(2)3)14-18-19(8,9)16(4,5)6/h10,12H,1,11,13-14H2,2-9H3/t17-/m1/s1
InChIKeyUELPCXPDBSSHNY-QGZVFWFLSA-N
XLogP5.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(2R,3R)-2,3,6-trimethylhept-5-enoxy]silane
CID 154722229
(+/-)-Lavandulol, TBDMS derivative
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Silane, dimethyl(non-3-enyloxy)isohexyloxy-
CID 91698241
tert-butyl-[[1-[(Z)-4-iodobut-3-enyl]cyclohexa-2,5-dien-1-yl]methoxy]-dimethylsilane
CID 10873143
Tert-butyl-[[1-(3-iodobut-3-enyl)cyclohexa-2,5-dien-1-yl]methoxy]-dimethylsilane
CID 11761261
tert-butyl-[2-[(1E,4E,8Z)-cyclodeca-1,4,8-trien-1-yl]ethoxy]-dimethylsilane
CID 57333047
Tert-butyl-[(4-hexyl-1,5-dimethylcyclohexa-2,4-dien-1-yl)methoxy]-dimethylsilane
CID 101400085
Tert-butyl-[(1,5-dimethylcyclohexa-2,4-dien-1-yl)methoxy]-dimethylsilane
CID 101400087
[(5E)-4-[(1E)-buta-1,3-dienyl]octa-5,7-dienoxy]-tert-butyl-dimethylsilane
CID 102150886
tert-butyl-[(E,2R)-4-ethyl-2-methylhept-4-enoxy]-dimethylsilane
CID 134963593
tert-butyl-[(3E)-3-ethylidenehex-5-enoxy]-dimethylsilane
CID 134991456
[(3E,6Z,9Z)-4,6-dimethylundeca-3,6,9-trienoxy]-tri(propan-2-yl)silane
CID 135008415

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane (CID 24823998) is tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane is C=C[C@](C)(CCC=C(C)C)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane?
The InChIKey is UELPCXPDBSSHNY-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H34OSi/c1-10-17(7,13-11-12-15(2)3)14-18-19(8,9)16(4,5)6/h10,12H,1,11,13-14H2,2-9H3/t17-/m1/s1.
What are the key properties of tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane?
tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane has a molecular weight of 282.54 g/mol, XLogP of 5.95, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2S)-2-ethenyl-2,6-dimethylhept-5-enoxy]-dimethylsilane is sourced from PubChem (CID 24823998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).