diethoxy-isocyano-pentan-2-yloxysilane

C10H21NO3Si — CID 141161615

IUPACdiethoxy-isocyano-pentan-2-yloxysilane
SMILES[C-]#[N+][Si](OCC)(OCC)OC(C)CCC
InChIInChI=1S/C10H21NO3Si/c1-6-9-10(4)14-15(11-5,12-7-2)13-8-3/h10H,6-9H2,1-4H3
InChIKeyHLYXGPQRAJKREY-UHFFFAOYSA-N
MW231.37 g/mol
LogP2.62
Rot. Bonds8

About diethoxy-isocyano-pentan-2-yloxysilane

diethoxy-isocyano-pentan-2-yloxysilane (PubChem CID 141161615) has the molecular formula C10H21NO3Si and a molecular weight of 231.37 g/mol. Its IUPAC name is diethoxy-isocyano-pentan-2-yloxysilane.

Molecular Properties

Compound Namediethoxy-isocyano-pentan-2-yloxysilane
PubChem CID141161615
Molecular FormulaC10H21NO3Si
Molecular Weight231.37 g/mol
Exact Mass231.13
IUPAC Namediethoxy-isocyano-pentan-2-yloxysilane
SMILES[C-]#[N+][Si](OCC)(OCC)OC(C)CCC
InChIInChI=1S/C10H21NO3Si/c1-6-9-10(4)14-15(11-5,12-7-2)13-8-3/h10H,6-9H2,1-4H3
InChIKeyHLYXGPQRAJKREY-UHFFFAOYSA-N
XLogP2.62
TPSA32.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.37
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

trimethyl(pentan-2-yloxy)silane
CID 552847
diethoxy-isocyano-pentoxysilane
CID 141371677
dimethyl-(2-methylpropoxy)-pentan-2-yloxysilane
CID 91726675
diethoxy-bis(2-methylpentyl)silane
CID 178181643
ethoxy-(1-isocyanopropan-2-yloxy)-methyl-propylsilane
CID 159005238
diethyl-octadecoxy-pentan-2-yloxysilane
CID 91744997
diethyl-(4-methylpentoxy)-pentan-2-yloxysilane
CID 91738212
2-[di(pentan-2-yloxy)methoxy]pentane
CID 19428773
butoxy-dimethyl-pentan-2-yloxysilane
CID 91726705
diethoxy-hexadecan-2-yloxy-methylsilane
CID 176915381
dimethyl-octoxy-pentan-2-yloxysilane
CID 91736775
diethoxy-hexadecan-2-yloxy-hydroxysilane
CID 176893996

Frequently Asked Questions

What is the IUPAC name of diethoxy-isocyano-pentan-2-yloxysilane?
The IUPAC name of diethoxy-isocyano-pentan-2-yloxysilane (CID 141161615) is diethoxy-isocyano-pentan-2-yloxysilane.
What is the SMILES notation for diethoxy-isocyano-pentan-2-yloxysilane?
The canonical SMILES for diethoxy-isocyano-pentan-2-yloxysilane is [C-]#[N+][Si](OCC)(OCC)OC(C)CCC.
What is the InChIKey of diethoxy-isocyano-pentan-2-yloxysilane?
The InChIKey is HLYXGPQRAJKREY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3Si/c1-6-9-10(4)14-15(11-5,12-7-2)13-8-3/h10H,6-9H2,1-4H3.
What are the key properties of diethoxy-isocyano-pentan-2-yloxysilane?
diethoxy-isocyano-pentan-2-yloxysilane has a molecular weight of 231.37 g/mol, XLogP of 2.62, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-isocyano-pentan-2-yloxysilane is sourced from PubChem (CID 141161615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).