trimethoxy-[4-(oxiran-2-yl)phenyl]silane

C11H16O4Si — CID 87194060

IUPACtrimethoxy-[4-(oxiran-2-yl)phenyl]silane
SMILESCO[Si](OC)(OC)c1ccc(C2CO2)cc1
InChIInChI=1S/C11H16O4Si/c1-12-16(13-2,14-3)10-6-4-9(5-7-10)11-8-15-11/h4-7,11H,8H2,1-3H3
InChIKeyUYNJTNKLLRQMOZ-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.84
Rot. Bonds5

About trimethoxy-[4-(oxiran-2-yl)phenyl]silane

trimethoxy-[4-(oxiran-2-yl)phenyl]silane (PubChem CID 87194060) has the molecular formula C11H16O4Si and a molecular weight of 240.33 g/mol. Its IUPAC name is trimethoxy-[4-(oxiran-2-yl)phenyl]silane.

Molecular Properties

Compound Nametrimethoxy-[4-(oxiran-2-yl)phenyl]silane
PubChem CID87194060
Molecular FormulaC11H16O4Si
Molecular Weight240.33 g/mol
Exact Mass240.08
IUPAC Nametrimethoxy-[4-(oxiran-2-yl)phenyl]silane
SMILESCO[Si](OC)(OC)c1ccc(C2CO2)cc1
InChIInChI=1S/C11H16O4Si/c1-12-16(13-2,14-3)10-6-4-9(5-7-10)11-8-15-11/h4-7,11H,8H2,1-3H3
InChIKeyUYNJTNKLLRQMOZ-UHFFFAOYSA-N
XLogP0.84
TPSA40.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.84
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 trimethoxy-[4-(oxiran-2-yl)phenyl]silane?
The IUPAC name of trimethoxy-[4-(oxiran-2-yl)phenyl]silane (CID 87194060) is trimethoxy-[4-(oxiran-2-yl)phenyl]silane.
What is the SMILES notation for trimethoxy-[4-(oxiran-2-yl)phenyl]silane?
The canonical SMILES for trimethoxy-[4-(oxiran-2-yl)phenyl]silane is CO[Si](OC)(OC)c1ccc(C2CO2)cc1.
What is the InChIKey of trimethoxy-[4-(oxiran-2-yl)phenyl]silane?
The InChIKey is UYNJTNKLLRQMOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O4Si/c1-12-16(13-2,14-3)10-6-4-9(5-7-10)11-8-15-11/h4-7,11H,8H2,1-3H3.
What are the key properties of trimethoxy-[4-(oxiran-2-yl)phenyl]silane?
trimethoxy-[4-(oxiran-2-yl)phenyl]silane has a molecular weight of 240.33 g/mol, XLogP of 0.84, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[4-(oxiran-2-yl)phenyl]silane is sourced from PubChem (CID 87194060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).