diethoxy-ethyl-pentadecan-2-yloxysilane

C21H46O3Si — CID 161487251

IUPACdiethoxy-ethyl-pentadecan-2-yloxysilane
SMILESCCCCCCCCCCCCCC(C)O[Si](CC)(OCC)OCC
InChIInChI=1S/C21H46O3Si/c1-6-10-11-12-13-14-15-16-17-18-19-20-21(5)24-25(9-4,22-7-2)23-8-3/h21H,6-20H2,1-5H3
InChIKeyWFDCPNYQASILDL-UHFFFAOYSA-N
MW374.68 g/mol
LogP7.12
Rot. Bonds19

About diethoxy-ethyl-pentadecan-2-yloxysilane

diethoxy-ethyl-pentadecan-2-yloxysilane (PubChem CID 161487251) has the molecular formula C21H46O3Si and a molecular weight of 374.68 g/mol. Its IUPAC name is diethoxy-ethyl-pentadecan-2-yloxysilane.

Molecular Properties

Compound Namediethoxy-ethyl-pentadecan-2-yloxysilane
PubChem CID161487251
Molecular FormulaC21H46O3Si
Molecular Weight374.68 g/mol
Exact Mass374.32
IUPAC Namediethoxy-ethyl-pentadecan-2-yloxysilane
SMILESCCCCCCCCCCCCCC(C)O[Si](CC)(OCC)OCC
InChIInChI=1S/C21H46O3Si/c1-6-10-11-12-13-14-15-16-17-18-19-20-21(5)24-25(9-4,22-7-2)23-8-3/h21H,6-20H2,1-5H3
InChIKeyWFDCPNYQASILDL-UHFFFAOYSA-N
XLogP7.12
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.68
LogP ≤ 57.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

diethoxy-octyl-pentadecan-2-yloxysilane
CID 150899900
diethoxy-hexadecan-2-yloxy-methylsilane
CID 176915381
diethoxy-hexadecan-2-yloxy-hydroxysilane
CID 176893996
triethyl(tetradecan-2-yloxy)silane
CID 568550
ethenyl-ethoxy-methyl-octan-2-yloxysilane
CID 91723234
butyl-dimethyl-tetradecan-2-yloxysilane
CID 554593
triethoxy(2-heptylundecyl)silane
CID 139707869
diethoxy-ethyl-propan-2-yloxysilane
CID 18331965
chloromethyl-dimethyl-tridecan-2-yloxysilane
CID 554737
1-triethoxysilylheptan-2-amine
CID 90410833
dimethyl-(2-methylpropoxy)-octan-2-yloxysilane
CID 91726674
2-ethoxytridecane
CID 54143367

Frequently Asked Questions

What is the IUPAC name of diethoxy-ethyl-pentadecan-2-yloxysilane?
The IUPAC name of diethoxy-ethyl-pentadecan-2-yloxysilane (CID 161487251) is diethoxy-ethyl-pentadecan-2-yloxysilane.
What is the SMILES notation for diethoxy-ethyl-pentadecan-2-yloxysilane?
The canonical SMILES for diethoxy-ethyl-pentadecan-2-yloxysilane is CCCCCCCCCCCCCC(C)O[Si](CC)(OCC)OCC.
What is the InChIKey of diethoxy-ethyl-pentadecan-2-yloxysilane?
The InChIKey is WFDCPNYQASILDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46O3Si/c1-6-10-11-12-13-14-15-16-17-18-19-20-21(5)24-25(9-4,22-7-2)23-8-3/h21H,6-20H2,1-5H3.
What are the key properties of diethoxy-ethyl-pentadecan-2-yloxysilane?
diethoxy-ethyl-pentadecan-2-yloxysilane has a molecular weight of 374.68 g/mol, XLogP of 7.12, 19 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-ethyl-pentadecan-2-yloxysilane is sourced from PubChem (CID 161487251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).