diethyl-hexoxy-undecoxysilane

C21H46O2Si — CID 91742902

IUPACdiethyl-hexoxy-undecoxysilane
SMILESCCCCCCCCCCCO[Si](CC)(CC)OCCCCCC
InChIInChI=1S/C21H46O2Si/c1-5-9-11-13-14-15-16-17-19-21-23-24(7-3,8-4)22-20-18-12-10-6-2/h5-21H2,1-4H3
InChIKeyNHIFTAULEXLDDB-UHFFFAOYSA-N
MW358.68 g/mol
LogP7.61
Rot. Bonds19

About diethyl-hexoxy-undecoxysilane

diethyl-hexoxy-undecoxysilane (PubChem CID 91742902) has the molecular formula C21H46O2Si and a molecular weight of 358.68 g/mol. Its IUPAC name is diethyl-hexoxy-undecoxysilane.

Molecular Properties

Compound Namediethyl-hexoxy-undecoxysilane
PubChem CID91742902
Molecular FormulaC21H46O2Si
Molecular Weight358.68 g/mol
Exact Mass358.33
IUPAC Namediethyl-hexoxy-undecoxysilane
SMILESCCCCCCCCCCCO[Si](CC)(CC)OCCCCCC
InChIInChI=1S/C21H46O2Si/c1-5-9-11-13-14-15-16-17-19-21-23-24(7-3,8-4)22-20-18-12-10-6-2/h5-21H2,1-4H3
InChIKeyNHIFTAULEXLDDB-UHFFFAOYSA-N
XLogP7.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.68
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze diethyl-hexoxy-undecoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

decoxy-diethyl-nonoxysilane
CID 91743782
diethyl-pentadecoxy-tridecoxysilane
CID 91745757
diethyl-pentadecoxy-tetradecoxysilane
CID 91745841
dodecoxy-diethyl-octoxysilane
CID 91744145
diethyl-pentoxy-undecoxysilane
CID 91742318
diethyl-nonoxy-pentoxysilane
CID 91741088
diethyl-(2-methoxyethoxy)-octoxysilane
CID 91739391
diethyl-hexadecoxy-(2-methylpropoxy)silane
CID 91744158
diethyl-(3-methylbutoxy)-pentadecoxysilane
CID 91744142
dodec-9-ynoxy-diethyl-undecoxysilane
CID 91737547
diethyl-hexoxy-(2-methylbutoxy)silane
CID 91738220
diethyl-(2-ethylbutoxy)-pentoxysilane
CID 91738238

Frequently Asked Questions

What is the IUPAC name of diethyl-hexoxy-undecoxysilane?
The IUPAC name of diethyl-hexoxy-undecoxysilane (CID 91742902) is diethyl-hexoxy-undecoxysilane.
What is the SMILES notation for diethyl-hexoxy-undecoxysilane?
The canonical SMILES for diethyl-hexoxy-undecoxysilane is CCCCCCCCCCCO[Si](CC)(CC)OCCCCCC.
What is the InChIKey of diethyl-hexoxy-undecoxysilane?
The InChIKey is NHIFTAULEXLDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46O2Si/c1-5-9-11-13-14-15-16-17-19-21-23-24(7-3,8-4)22-20-18-12-10-6-2/h5-21H2,1-4H3.
What are the key properties of diethyl-hexoxy-undecoxysilane?
diethyl-hexoxy-undecoxysilane has a molecular weight of 358.68 g/mol, XLogP of 7.61, 19 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-hexoxy-undecoxysilane is sourced from PubChem (CID 91742902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).