diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane

C11H24O4Si — CID 141007353

IUPACdiethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane
SMILESCCCOC1([Si](C)(OCC)OCC)OC1C
InChIInChI=1S/C11H24O4Si/c1-6-9-12-11(10(4)15-11)16(5,13-7-2)14-8-3/h10H,6-9H2,1-5H3
InChIKeyYKXXTGGSJBTXBM-UHFFFAOYSA-N
MW248.39 g/mol
LogP2.21
Rot. Bonds8

About diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane

diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane (PubChem CID 141007353) has the molecular formula C11H24O4Si and a molecular weight of 248.39 g/mol. Its IUPAC name is diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane.

Molecular Properties

Compound Namediethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane
PubChem CID141007353
Molecular FormulaC11H24O4Si
Molecular Weight248.39 g/mol
Exact Mass248.14
IUPAC Namediethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane
SMILESCCCOC1([Si](C)(OCC)OCC)OC1C
InChIInChI=1S/C11H24O4Si/c1-6-9-12-11(10(4)15-11)16(5,13-7-2)14-8-3/h10H,6-9H2,1-5H3
InChIKeyYKXXTGGSJBTXBM-UHFFFAOYSA-N
XLogP2.21
TPSA40.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane?
The IUPAC name of diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane (CID 141007353) is diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane.
What is the SMILES notation for diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane?
The canonical SMILES for diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane is CCCOC1([Si](C)(OCC)OCC)OC1C.
What is the InChIKey of diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane?
The InChIKey is YKXXTGGSJBTXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si/c1-6-9-12-11(10(4)15-11)16(5,13-7-2)14-8-3/h10H,6-9H2,1-5H3.
What are the key properties of diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane?
diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane has a molecular weight of 248.39 g/mol, XLogP of 2.21, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-methyl-(3-methyl-2-propoxyoxiran-2-yl)silane is sourced from PubChem (CID 141007353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).