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

C9H20O5Si — CID 87772806

IUPACtrimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane
SMILESCCCOC1([Si](OC)(OC)OC)OC1C
InChIInChI=1S/C9H20O5Si/c1-6-7-13-9(8(2)14-9)15(10-3,11-4)12-5/h8H,6-7H2,1-5H3
InChIKeyNUANKVDTEBIXHW-UHFFFAOYSA-N
MW236.34 g/mol
LogP0.95
Rot. Bonds7

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

trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane (PubChem CID 87772806) has the molecular formula C9H20O5Si and a molecular weight of 236.34 g/mol. Its IUPAC name is trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane.

Molecular Properties

Compound Nametrimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane
PubChem CID87772806
Molecular FormulaC9H20O5Si
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Nametrimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane
SMILESCCCOC1([Si](OC)(OC)OC)OC1C
InChIInChI=1S/C9H20O5Si/c1-6-7-13-9(8(2)14-9)15(10-3,11-4)12-5/h8H,6-7H2,1-5H3
InChIKeyNUANKVDTEBIXHW-UHFFFAOYSA-N
XLogP0.95
TPSA49.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane?
The IUPAC name of trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane (CID 87772806) is trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane.
What is the SMILES notation for trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane?
The canonical SMILES for trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane is CCCOC1([Si](OC)(OC)OC)OC1C.
What is the InChIKey of trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane?
The InChIKey is NUANKVDTEBIXHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O5Si/c1-6-7-13-9(8(2)14-9)15(10-3,11-4)12-5/h8H,6-7H2,1-5H3.
What are the key properties of trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane?
trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane has a molecular weight of 236.34 g/mol, XLogP of 0.95, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-(3-methyl-2-propoxyoxiran-2-yl)silane is sourced from PubChem (CID 87772806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).