trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane

C11H22OSi — CID 11275650

IUPACtrimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane
SMILESC=C(/C=C/CC(C)C)O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-10(2)8-7-9-11(3)12-13(4,5)6/h7,9-10H,3,8H2,1-2,4-6H3/b9-7+
InChIKeyMHIHDXOJSGVNQT-VQHVLOKHSA-N
MW198.38 g/mol
LogP3.95
Rot. Bonds5

About trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane

trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane (PubChem CID 11275650) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane
PubChem CID11275650
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Nametrimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane
SMILESC=C(/C=C/CC(C)C)O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-10(2)8-7-9-11(3)12-13(4,5)6/h7,9-10H,3,8H2,1-2,4-6H3/b9-7+
InChIKeyMHIHDXOJSGVNQT-VQHVLOKHSA-N
XLogP3.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
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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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane?
The IUPAC name of trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane (CID 11275650) is trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane.
What is the SMILES notation for trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane?
The canonical SMILES for trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane is C=C(/C=C/CC(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane?
The InChIKey is MHIHDXOJSGVNQT-VQHVLOKHSA-N. The full InChI is InChI=1S/C11H22OSi/c1-10(2)8-7-9-11(3)12-13(4,5)6/h7,9-10H,3,8H2,1-2,4-6H3/b9-7+.
What are the key properties of trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane?
trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane has a molecular weight of 198.38 g/mol, XLogP of 3.95, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3E)-6-methylhepta-1,3-dien-2-yl]oxysilane is sourced from PubChem (CID 11275650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).