tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane

C11H22OSi — CID 15239765

IUPACtert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane
SMILESC=C(C)/C=C/O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22OSi/c1-10(2)8-9-12-13(6,7)11(3,4)5/h8-9H,1H2,2-7H3/b9-8+
InChIKeyXUIVSWJJVAHSHW-CMDGGOBGSA-N
MW198.38 g/mol
LogP4.10
Rot. Bonds3

About tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane

tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane (PubChem CID 15239765) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane
PubChem CID15239765
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Nametert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane
SMILESC=C(C)/C=C/O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H22OSi/c1-10(2)8-9-12-13(6,7)11(3,4)5/h8-9H,1H2,2-7H3/b9-8+
InChIKeyXUIVSWJJVAHSHW-CMDGGOBGSA-N
XLogP4.10
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 ≤ 54.10
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

Silane, ((1E)-1-buten-1-yloxy)trimethyl-
CID 6436520
1-Triethylsiloxy-1,3-butadiene (cis+trans)
CID 6175546
Trimethyl[[(1E,3E)-2-methylpenta-1,3-dien-1-yl]oxy]silane
CID 10964963
(But-3-enyloxy)(tert-butyl)dimethylsilane
CID 10008065
Silane, (1,1-dimethylethyl)dimethyl(4-pentenyloxy)-
CID 10987285
Silane, ((1Z)-1-buten-1-yloxy)trimethyl-
CID 6436519
Trimethyl-((1E)-2-methylbuta-1,3-dienoxy)silane
CID 3037370
1-(T-Butyldimethylsiloxy)-1,3-butadiene
CID 53406248
Trimethyl(pent-1-enoxy)silane
CID 73028039
Trimethyl(3-methylbut-1-enoxy)silane
CID 85247119
InChI=1/C8H16OSi/c1-8(2)6-7-9-10(3,4)5/h6-7H,1H2,2-5H3/b7-6
CID 5324020
trimethyl-[(Z)-3-methylbut-1-enoxy]silane
CID 134875805

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane (CID 15239765) is tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane is C=C(C)/C=C/O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane?
The InChIKey is XUIVSWJJVAHSHW-CMDGGOBGSA-N. The full InChI is InChI=1S/C11H22OSi/c1-10(2)8-9-12-13(6,7)11(3,4)5/h8-9H,1H2,2-7H3/b9-8+.
What are the key properties of tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane?
tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane has a molecular weight of 198.38 g/mol, XLogP of 4.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1E)-3-methylbuta-1,3-dienoxy]silane is sourced from PubChem (CID 15239765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).