trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane

C9H18O2Si — CID 11159754

IUPACtrimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane
SMILESC[Si](C)(C)OC1=CCCCCO1
InChIInChI=1S/C9H18O2Si/c1-12(2,3)11-9-7-5-4-6-8-10-9/h7H,4-6,8H2,1-3H3
InChIKeyQFTZNDXGRJJETP-UHFFFAOYSA-N
MW186.33 g/mol
LogP2.88
Rot. Bonds2

About trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane

trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane (PubChem CID 11159754) has the molecular formula C9H18O2Si and a molecular weight of 186.33 g/mol. Its IUPAC name is trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane.

Molecular Properties

Compound Nametrimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane
PubChem CID11159754
Molecular FormulaC9H18O2Si
Molecular Weight186.33 g/mol
Exact Mass186.11
IUPAC Nametrimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane
SMILESC[Si](C)(C)OC1=CCCCCO1
InChIInChI=1S/C9H18O2Si/c1-12(2,3)11-9-7-5-4-6-8-10-9/h7H,4-6,8H2,1-3H3
InChIKeyQFTZNDXGRJJETP-UHFFFAOYSA-N
XLogP2.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.33
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane?
The IUPAC name of trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane (CID 11159754) is trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane.
What is the SMILES notation for trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane?
The canonical SMILES for trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane is C[Si](C)(C)OC1=CCCCCO1.
What is the InChIKey of trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane?
The InChIKey is QFTZNDXGRJJETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2Si/c1-12(2,3)11-9-7-5-4-6-8-10-9/h7H,4-6,8H2,1-3H3.
What are the key properties of trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane?
trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane has a molecular weight of 186.33 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(2,3,4,5-tetrahydrooxepin-7-yloxy)silane is sourced from PubChem (CID 11159754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).