diethoxy-ethyliodanuidyl-(methoxymethyl)silane

C8H20IO3Si- — CID 161206412

IUPACdiethoxy-ethyliodanuidyl-(methoxymethyl)silane
SMILESCCO[Si](COC)(OCC)[I-]CC
InChIInChI=1S/C8H20IO3Si/c1-5-9-13(8-10-4,11-6-2)12-7-3/h5-8H2,1-4H3/q-1
InChIKeyZTJDGDRTDWNGLA-UHFFFAOYSA-N
MW319.24 g/mol
LogP-1.71
Rot. Bonds8

About diethoxy-ethyliodanuidyl-(methoxymethyl)silane

diethoxy-ethyliodanuidyl-(methoxymethyl)silane (PubChem CID 161206412) has the molecular formula C8H20IO3Si- and a molecular weight of 319.24 g/mol. Its IUPAC name is diethoxy-ethyliodanuidyl-(methoxymethyl)silane.

Molecular Properties

Compound Namediethoxy-ethyliodanuidyl-(methoxymethyl)silane
PubChem CID161206412
Molecular FormulaC8H20IO3Si-
Molecular Weight319.24 g/mol
Exact Mass319.02
IUPAC Namediethoxy-ethyliodanuidyl-(methoxymethyl)silane
SMILESCCO[Si](COC)(OCC)[I-]CC
InChIInChI=1S/C8H20IO3Si/c1-5-9-13(8-10-4,11-6-2)12-7-3/h5-8H2,1-4H3/q-1
InChIKeyZTJDGDRTDWNGLA-UHFFFAOYSA-N
XLogP-1.71
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.24
LogP ≤ 5-1.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
The IUPAC name of diethoxy-ethyliodanuidyl-(methoxymethyl)silane (CID 161206412) is diethoxy-ethyliodanuidyl-(methoxymethyl)silane.
What is the SMILES notation for diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
The canonical SMILES for diethoxy-ethyliodanuidyl-(methoxymethyl)silane is CCO[Si](COC)(OCC)[I-]CC.
What is the InChIKey of diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
The InChIKey is ZTJDGDRTDWNGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20IO3Si/c1-5-9-13(8-10-4,11-6-2)12-7-3/h5-8H2,1-4H3/q-1.
What are the key properties of diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
diethoxy-ethyliodanuidyl-(methoxymethyl)silane has a molecular weight of 319.24 g/mol, XLogP of -1.71, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-ethyliodanuidyl-(methoxymethyl)silane is sourced from PubChem (CID 161206412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).