3-ethylhex-5-yn-3-yloxy(trimethyl)silane

C11H22OSi — CID 22460028

IUPAC3-ethylhex-5-yn-3-yloxy(trimethyl)silane
SMILESC#CCC(CC)(CC)O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-7-10-11(8-2,9-3)12-13(4,5)6/h1H,8-10H2,2-6H3
InChIKeyPDPOJRYMCBFIQS-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.42
Rot. Bonds5

About 3-ethylhex-5-yn-3-yloxy(trimethyl)silane

3-ethylhex-5-yn-3-yloxy(trimethyl)silane (PubChem CID 22460028) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 3-ethylhex-5-yn-3-yloxy(trimethyl)silane.

Molecular Properties

Compound Name3-ethylhex-5-yn-3-yloxy(trimethyl)silane
PubChem CID22460028
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name3-ethylhex-5-yn-3-yloxy(trimethyl)silane
SMILESC#CCC(CC)(CC)O[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-7-10-11(8-2,9-3)12-13(4,5)6/h1H,8-10H2,2-6H3
InChIKeyPDPOJRYMCBFIQS-UHFFFAOYSA-N
XLogP3.42
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 ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-ethylhex-5-yn-3-yloxy(trimethyl)silane?
The IUPAC name of 3-ethylhex-5-yn-3-yloxy(trimethyl)silane (CID 22460028) is 3-ethylhex-5-yn-3-yloxy(trimethyl)silane.
What is the SMILES notation for 3-ethylhex-5-yn-3-yloxy(trimethyl)silane?
The canonical SMILES for 3-ethylhex-5-yn-3-yloxy(trimethyl)silane is C#CCC(CC)(CC)O[Si](C)(C)C.
What is the InChIKey of 3-ethylhex-5-yn-3-yloxy(trimethyl)silane?
The InChIKey is PDPOJRYMCBFIQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-7-10-11(8-2,9-3)12-13(4,5)6/h1H,8-10H2,2-6H3.
What are the key properties of 3-ethylhex-5-yn-3-yloxy(trimethyl)silane?
3-ethylhex-5-yn-3-yloxy(trimethyl)silane has a molecular weight of 198.38 g/mol, XLogP of 3.42, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylhex-5-yn-3-yloxy(trimethyl)silane is sourced from PubChem (CID 22460028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).