3,3-diethoxyoxadisilinane

C7H18O3Si2 — CID 173106077

IUPAC3,3-diethoxyoxadisilinane
SMILESCCO[Si]1(OCC)CCCO[SiH2]1
InChIInChI=1S/C7H18O3Si2/c1-3-9-12(10-4-2)7-5-6-8-11-12/h3-7,11H2,1-2H3
InChIKeyTWXJOBLKFRSBFH-UHFFFAOYSA-N
MW206.39 g/mol
LogP0.50
Rot. Bonds4

About 3,3-diethoxyoxadisilinane

3,3-diethoxyoxadisilinane (PubChem CID 173106077) has the molecular formula C7H18O3Si2 and a molecular weight of 206.39 g/mol. Its IUPAC name is 3,3-diethoxyoxadisilinane.

Molecular Properties

Compound Name3,3-diethoxyoxadisilinane
PubChem CID173106077
Molecular FormulaC7H18O3Si2
Molecular Weight206.39 g/mol
Exact Mass206.08
IUPAC Name3,3-diethoxyoxadisilinane
SMILESCCO[Si]1(OCC)CCCO[SiH2]1
InChIInChI=1S/C7H18O3Si2/c1-3-9-12(10-4-2)7-5-6-8-11-12/h3-7,11H2,1-2H3
InChIKeyTWXJOBLKFRSBFH-UHFFFAOYSA-N
XLogP0.50
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.39
LogP ≤ 50.50
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 3,3-diethoxyoxadisilinane?
The IUPAC name of 3,3-diethoxyoxadisilinane (CID 173106077) is 3,3-diethoxyoxadisilinane.
What is the SMILES notation for 3,3-diethoxyoxadisilinane?
The canonical SMILES for 3,3-diethoxyoxadisilinane is CCO[Si]1(OCC)CCCO[SiH2]1.
What is the InChIKey of 3,3-diethoxyoxadisilinane?
The InChIKey is TWXJOBLKFRSBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O3Si2/c1-3-9-12(10-4-2)7-5-6-8-11-12/h3-7,11H2,1-2H3.
What are the key properties of 3,3-diethoxyoxadisilinane?
3,3-diethoxyoxadisilinane has a molecular weight of 206.39 g/mol, XLogP of 0.50, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethoxyoxadisilinane is sourced from PubChem (CID 173106077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).