2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane

C8H16O3Si — CID 140677313

IUPAC2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane
SMILESC=C[Si]1(OC)OCC(C)(C)CO1
InChIInChI=1S/C8H16O3Si/c1-5-12(9-4)10-6-8(2,3)7-11-12/h5H,1,6-7H2,2-4H3
InChIKeyOKQLFHIXVORZMH-UHFFFAOYSA-N
MW188.30 g/mol
LogP1.37
Rot. Bonds2

About 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane

2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane (PubChem CID 140677313) has the molecular formula C8H16O3Si and a molecular weight of 188.30 g/mol. Its IUPAC name is 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane.

Molecular Properties

Compound Name2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane
PubChem CID140677313
Molecular FormulaC8H16O3Si
Molecular Weight188.30 g/mol
Exact Mass188.09
IUPAC Name2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane
SMILESC=C[Si]1(OC)OCC(C)(C)CO1
InChIInChI=1S/C8H16O3Si/c1-5-12(9-4)10-6-8(2,3)7-11-12/h5H,1,6-7H2,2-4H3
InChIKeyOKQLFHIXVORZMH-UHFFFAOYSA-N
XLogP1.37
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 51.37
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 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane?
The IUPAC name of 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane (CID 140677313) is 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane.
What is the SMILES notation for 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane?
The canonical SMILES for 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane is C=C[Si]1(OC)OCC(C)(C)CO1.
What is the InChIKey of 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane?
The InChIKey is OKQLFHIXVORZMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3Si/c1-5-12(9-4)10-6-8(2,3)7-11-12/h5H,1,6-7H2,2-4H3.
What are the key properties of 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane?
2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane has a molecular weight of 188.30 g/mol, XLogP of 1.37, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-2-methoxy-5,5-dimethyl-1,3,2-dioxasilinane is sourced from PubChem (CID 140677313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).