trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane

C13H22OSi — CID 10262993

IUPACtrimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane
SMILESC[Si](C)(C)C#CC/C=C/C1CCCCO1
InChIInChI=1S/C13H22OSi/c1-15(2,3)12-8-4-5-9-13-10-6-7-11-14-13/h5,9,13H,4,6-7,10-11H2,1-3H3/b9-5+
InChIKeyYRBWASUFPOAPAM-WEVVVXLNSA-N
MW222.40 g/mol
LogP3.38
Rot. Bonds2

About trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane

trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane (PubChem CID 10262993) has the molecular formula C13H22OSi and a molecular weight of 222.40 g/mol. Its IUPAC name is trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane
PubChem CID10262993
Molecular FormulaC13H22OSi
Molecular Weight222.40 g/mol
Exact Mass222.14
IUPAC Nametrimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane
SMILESC[Si](C)(C)C#CC/C=C/C1CCCCO1
InChIInChI=1S/C13H22OSi/c1-15(2,3)12-8-4-5-9-13-10-6-7-11-14-13/h5,9,13H,4,6-7,10-11H2,1-3H3/b9-5+
InChIKeyYRBWASUFPOAPAM-WEVVVXLNSA-N
XLogP3.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.40
LogP ≤ 53.38
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane?
The IUPAC name of trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane (CID 10262993) is trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane.
What is the SMILES notation for trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane?
The canonical SMILES for trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane is C[Si](C)(C)C#CC/C=C/C1CCCCO1.
What is the InChIKey of trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane?
The InChIKey is YRBWASUFPOAPAM-WEVVVXLNSA-N. The full InChI is InChI=1S/C13H22OSi/c1-15(2,3)12-8-4-5-9-13-10-6-7-11-14-13/h5,9,13H,4,6-7,10-11H2,1-3H3/b9-5+.
What are the key properties of trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane?
trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane has a molecular weight of 222.40 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-5-(oxan-2-yl)pent-4-en-1-ynyl]silane is sourced from PubChem (CID 10262993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).