[(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane

C11H22OSi — CID 15706652

IUPAC[(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane
SMILESC=C(/C=C/C(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-10(12-13(5,6)7)8-9-11(2,3)4/h8-9H,1H2,2-7H3/b9-8+
InChIKeyDXMBBULJDPFXEO-CMDGGOBGSA-N
MW198.38 g/mol
LogP3.95
Rot. Bonds3

About [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane

[(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane (PubChem CID 15706652) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane
PubChem CID15706652
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name[(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane
SMILESC=C(/C=C/C(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-10(12-13(5,6)7)8-9-11(2,3)4/h8-9H,1H2,2-7H3/b9-8+
InChIKeyDXMBBULJDPFXEO-CMDGGOBGSA-N
XLogP3.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

2-(Trimethylsiloxy)-1,3-cyclohexadiene
CID 4095656
(E)-trimethyl(nona-1,3-dien-2-yloxy)silane
CID 86668734
Silane, [(4,4-dimethyl-1,5-cyclohexadien-1-yl)oxy]trimethyl-
CID 10035591
Tert-butyl-cyclohexa-1,5-dien-1-yloxy-dimethylsilane
CID 11042035
trimethyl-[(3E)-5-methylhexa-1,3-dien-2-yl]oxysilane
CID 11183042
Cyclopenta-1,4-dien-1-yloxy(triethyl)silane
CID 11424142
(3-Cyclopropylideneprop-1-en-2-yloxy)trimethylsilane
CID 15174784
Cyclohepta-1,6-dien-1-yloxy(trimethyl)silane
CID 13308700
Trimethyl-(3-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 13448214
(E)-trimethyl(3-methylpenta-1,3-dien-2-yloxy)silane
CID 13660030
Tert-butyl-(4,4-dimethylcyclohexa-1,5-dien-1-yl)oxy-dimethylsilane
CID 15473284
trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane
CID 11275650

Frequently Asked Questions

What is the IUPAC name of [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane?
The IUPAC name of [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane (CID 15706652) is [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane.
What is the SMILES notation for [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane?
The canonical SMILES for [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane is C=C(/C=C/C(C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane?
The InChIKey is DXMBBULJDPFXEO-CMDGGOBGSA-N. The full InChI is InChI=1S/C11H22OSi/c1-10(12-13(5,6)7)8-9-11(2,3)4/h8-9H,1H2,2-7H3/b9-8+.
What are the key properties of [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane?
[(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane has a molecular weight of 198.38 g/mol, XLogP of 3.95, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-5,5-dimethylhexa-1,3-dien-2-yl]oxy-trimethylsilane is sourced from PubChem (CID 15706652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).