tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane

C10H22O3Si — CID 152706381

IUPACtert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC1COCO1
InChIInChI=1S/C10H22O3Si/c1-10(2,3)14(4,5)13-7-9-6-11-8-12-9/h9H,6-8H2,1-5H3
InChIKeyZSQUHGJBJQBHSH-UHFFFAOYSA-N
MW218.37 g/mol
LogP2.38
Rot. Bonds3

About tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane

tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane (PubChem CID 152706381) has the molecular formula C10H22O3Si and a molecular weight of 218.37 g/mol. Its IUPAC name is tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane
PubChem CID152706381
Molecular FormulaC10H22O3Si
Molecular Weight218.37 g/mol
Exact Mass218.13
IUPAC Nametert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC1COCO1
InChIInChI=1S/C10H22O3Si/c1-10(2,3)14(4,5)13-7-9-6-11-8-12-9/h9H,6-8H2,1-5H3
InChIKeyZSQUHGJBJQBHSH-UHFFFAOYSA-N
XLogP2.38
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.37
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane (CID 152706381) is tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane is CC(C)(C)[Si](C)(C)OCC1COCO1.
What is the InChIKey of tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane?
The InChIKey is ZSQUHGJBJQBHSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3Si/c1-10(2,3)14(4,5)13-7-9-6-11-8-12-9/h9H,6-8H2,1-5H3.
What are the key properties of tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane?
tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane has a molecular weight of 218.37 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(1,3-dioxolan-4-ylmethoxy)-dimethylsilane is sourced from PubChem (CID 152706381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).