3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane

C5H16O3Si2 — CID 173282386

IUPAC3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane
SMILESCC1(C)OC1O.C[SiH2]O[SiH3]
InChIInChI=1S/C4H8O2.CH8OSi2/c1-4(2)3(5)6-4;1-4-2-3/h3,5H,1-2H3;4H2,1,3H3
InChIKeyILDZOTJPHMSVTD-UHFFFAOYSA-N
MW180.35 g/mol
LogP-1.47
Rot. Bonds1

About 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane

3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane (PubChem CID 173282386) has the molecular formula C5H16O3Si2 and a molecular weight of 180.35 g/mol. Its IUPAC name is 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane.

Molecular Properties

Compound Name3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane
PubChem CID173282386
Molecular FormulaC5H16O3Si2
Molecular Weight180.35 g/mol
Exact Mass180.06
IUPAC Name3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane
SMILESCC1(C)OC1O.C[SiH2]O[SiH3]
InChIInChI=1S/C4H8O2.CH8OSi2/c1-4(2)3(5)6-4;1-4-2-3/h3,5H,1-2H3;4H2,1,3H3
InChIKeyILDZOTJPHMSVTD-UHFFFAOYSA-N
XLogP-1.47
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.35
LogP ≤ 5-1.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane?
The IUPAC name of 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane (CID 173282386) is 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane.
What is the SMILES notation for 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane?
The canonical SMILES for 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane is CC1(C)OC1O.C[SiH2]O[SiH3].
What is the InChIKey of 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane?
The InChIKey is ILDZOTJPHMSVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2.CH8OSi2/c1-4(2)3(5)6-4;1-4-2-3/h3,5H,1-2H3;4H2,1,3H3.
What are the key properties of 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane?
3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane has a molecular weight of 180.35 g/mol, XLogP of -1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyloxiran-2-ol;methyl(silyloxy)silane is sourced from PubChem (CID 173282386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).