dihydroxy(oxan-3-yl)silane

C5H12O3Si — CID 173289947

IUPACdihydroxy(oxan-3-yl)silane
SMILESO[SiH](O)C1CCCOC1
InChIInChI=1S/C5H12O3Si/c6-9(7)5-2-1-3-8-4-5/h5-7,9H,1-4H2
InChIKeyYBESVBZMVCALGK-UHFFFAOYSA-N
MW148.23 g/mol
LogP-0.63
Rot. Bonds1

About dihydroxy(oxan-3-yl)silane

dihydroxy(oxan-3-yl)silane (PubChem CID 173289947) has the molecular formula C5H12O3Si and a molecular weight of 148.23 g/mol. Its IUPAC name is dihydroxy(oxan-3-yl)silane.

Molecular Properties

Compound Namedihydroxy(oxan-3-yl)silane
PubChem CID173289947
Molecular FormulaC5H12O3Si
Molecular Weight148.23 g/mol
Exact Mass148.06
IUPAC Namedihydroxy(oxan-3-yl)silane
SMILESO[SiH](O)C1CCCOC1
InChIInChI=1S/C5H12O3Si/c6-9(7)5-2-1-3-8-4-5/h5-7,9H,1-4H2
InChIKeyYBESVBZMVCALGK-UHFFFAOYSA-N
XLogP-0.63
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
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 dihydroxy(oxan-3-yl)silane?
The IUPAC name of dihydroxy(oxan-3-yl)silane (CID 173289947) is dihydroxy(oxan-3-yl)silane.
What is the SMILES notation for dihydroxy(oxan-3-yl)silane?
The canonical SMILES for dihydroxy(oxan-3-yl)silane is O[SiH](O)C1CCCOC1.
What is the InChIKey of dihydroxy(oxan-3-yl)silane?
The InChIKey is YBESVBZMVCALGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O3Si/c6-9(7)5-2-1-3-8-4-5/h5-7,9H,1-4H2.
What are the key properties of dihydroxy(oxan-3-yl)silane?
dihydroxy(oxan-3-yl)silane has a molecular weight of 148.23 g/mol, XLogP of -0.63, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(oxan-3-yl)silane is sourced from PubChem (CID 173289947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).