di(cyclooctyl)-dicyclopentyloxysilane

C26H48O2Si — CID 142301960

IUPACdi(cyclooctyl)-dicyclopentyloxysilane
SMILESC1CCCC([Si](OC2CCCC2)(OC2CCCC2)C2CCCCCCC2)CCC1
InChIInChI=1S/C26H48O2Si/c1-3-7-19-25(20-8-4-1)29(27-23-15-11-12-16-23,28-24-17-13-14-18-24)26-21-9-5-2-6-10-22-26/h23-26H,1-22H2
InChIKeyMHQITFHQKZICGT-UHFFFAOYSA-N
MW420.75 g/mol
LogP8.58
Rot. Bonds6

About di(cyclooctyl)-dicyclopentyloxysilane

di(cyclooctyl)-dicyclopentyloxysilane (PubChem CID 142301960) has the molecular formula C26H48O2Si and a molecular weight of 420.75 g/mol. Its IUPAC name is di(cyclooctyl)-dicyclopentyloxysilane.

Molecular Properties

Compound Namedi(cyclooctyl)-dicyclopentyloxysilane
PubChem CID142301960
Molecular FormulaC26H48O2Si
Molecular Weight420.75 g/mol
Exact Mass420.34
IUPAC Namedi(cyclooctyl)-dicyclopentyloxysilane
SMILESC1CCCC([Si](OC2CCCC2)(OC2CCCC2)C2CCCCCCC2)CCC1
InChIInChI=1S/C26H48O2Si/c1-3-7-19-25(20-8-4-1)29(27-23-15-11-12-16-23,28-24-17-13-14-18-24)26-21-9-5-2-6-10-22-26/h23-26H,1-22H2
InChIKeyMHQITFHQKZICGT-UHFFFAOYSA-N
XLogP8.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.75
LogP ≤ 58.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of di(cyclooctyl)-dicyclopentyloxysilane?
The IUPAC name of di(cyclooctyl)-dicyclopentyloxysilane (CID 142301960) is di(cyclooctyl)-dicyclopentyloxysilane.
What is the SMILES notation for di(cyclooctyl)-dicyclopentyloxysilane?
The canonical SMILES for di(cyclooctyl)-dicyclopentyloxysilane is C1CCCC([Si](OC2CCCC2)(OC2CCCC2)C2CCCCCCC2)CCC1.
What is the InChIKey of di(cyclooctyl)-dicyclopentyloxysilane?
The InChIKey is MHQITFHQKZICGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H48O2Si/c1-3-7-19-25(20-8-4-1)29(27-23-15-11-12-16-23,28-24-17-13-14-18-24)26-21-9-5-2-6-10-22-26/h23-26H,1-22H2.
What are the key properties of di(cyclooctyl)-dicyclopentyloxysilane?
di(cyclooctyl)-dicyclopentyloxysilane has a molecular weight of 420.75 g/mol, XLogP of 8.58, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for di(cyclooctyl)-dicyclopentyloxysilane is sourced from PubChem (CID 142301960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).