trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane

C14H26O2Si — CID 14652360

IUPACtrimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane
SMILESC[Si](C)(C)C#CCCCCOC1CCCCO1
InChIInChI=1S/C14H26O2Si/c1-17(2,3)13-9-5-4-7-11-15-14-10-6-8-12-16-14/h14H,4-8,10-12H2,1-3H3
InChIKeyGTJZZBGZNPWQBI-UHFFFAOYSA-N
MW254.45 g/mol
LogP3.58
Rot. Bonds5

About trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane

trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane (PubChem CID 14652360) has the molecular formula C14H26O2Si and a molecular weight of 254.45 g/mol. Its IUPAC name is trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane
PubChem CID14652360
Molecular FormulaC14H26O2Si
Molecular Weight254.45 g/mol
Exact Mass254.17
IUPAC Nametrimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane
SMILESC[Si](C)(C)C#CCCCCOC1CCCCO1
InChIInChI=1S/C14H26O2Si/c1-17(2,3)13-9-5-4-7-11-15-14-10-6-8-12-16-14/h14H,4-8,10-12H2,1-3H3
InChIKeyGTJZZBGZNPWQBI-UHFFFAOYSA-N
XLogP3.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.45
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane?
The IUPAC name of trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane (CID 14652360) is trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane.
What is the SMILES notation for trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane?
The canonical SMILES for trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane is C[Si](C)(C)C#CCCCCOC1CCCCO1.
What is the InChIKey of trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane?
The InChIKey is GTJZZBGZNPWQBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2Si/c1-17(2,3)13-9-5-4-7-11-15-14-10-6-8-12-16-14/h14H,4-8,10-12H2,1-3H3.
What are the key properties of trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane?
trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane has a molecular weight of 254.45 g/mol, XLogP of 3.58, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[6-(oxan-2-yloxy)hex-1-ynyl]silane is sourced from PubChem (CID 14652360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).