11-ethylperoxyundecyl(trimethoxy)silane

C16H36O5Si — CID 155643912

IUPAC11-ethylperoxyundecyl(trimethoxy)silane
SMILESCCOOCCCCCCCCCCC[Si](OC)(OC)OC
InChIInChI=1S/C16H36O5Si/c1-5-20-21-15-13-11-9-7-6-8-10-12-14-16-22(17-2,18-3)19-4/h5-16H2,1-4H3
InChIKeyAMBVWIQPWFORSN-UHFFFAOYSA-N
MW336.55 g/mol
LogP4.34
Rot. Bonds17

About 11-ethylperoxyundecyl(trimethoxy)silane

11-ethylperoxyundecyl(trimethoxy)silane (PubChem CID 155643912) has the molecular formula C16H36O5Si and a molecular weight of 336.55 g/mol. Its IUPAC name is 11-ethylperoxyundecyl(trimethoxy)silane.

Molecular Properties

Compound Name11-ethylperoxyundecyl(trimethoxy)silane
PubChem CID155643912
Molecular FormulaC16H36O5Si
Molecular Weight336.55 g/mol
Exact Mass336.23
IUPAC Name11-ethylperoxyundecyl(trimethoxy)silane
SMILESCCOOCCCCCCCCCCC[Si](OC)(OC)OC
InChIInChI=1S/C16H36O5Si/c1-5-20-21-15-13-11-9-7-6-8-10-12-14-16-22(17-2,18-3)19-4/h5-16H2,1-4H3
InChIKeyAMBVWIQPWFORSN-UHFFFAOYSA-N
XLogP4.34
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.55
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 11-ethylperoxyundecyl(trimethoxy)silane?
The IUPAC name of 11-ethylperoxyundecyl(trimethoxy)silane (CID 155643912) is 11-ethylperoxyundecyl(trimethoxy)silane.
What is the SMILES notation for 11-ethylperoxyundecyl(trimethoxy)silane?
The canonical SMILES for 11-ethylperoxyundecyl(trimethoxy)silane is CCOOCCCCCCCCCCC[Si](OC)(OC)OC.
What is the InChIKey of 11-ethylperoxyundecyl(trimethoxy)silane?
The InChIKey is AMBVWIQPWFORSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O5Si/c1-5-20-21-15-13-11-9-7-6-8-10-12-14-16-22(17-2,18-3)19-4/h5-16H2,1-4H3.
What are the key properties of 11-ethylperoxyundecyl(trimethoxy)silane?
11-ethylperoxyundecyl(trimethoxy)silane has a molecular weight of 336.55 g/mol, XLogP of 4.34, 17 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethylperoxyundecyl(trimethoxy)silane is sourced from PubChem (CID 155643912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).